| 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 | 28.7 | Very low | 35.9 | Very low | 239 Ų | 239 | 155.6 Ų | 155.6 | 100% | 1.177 | 80% | 0.797 | S | S | * | * | 0 | 144.6 | 0 | -147.2 | 160.5 | -172.8 | 0 | 0 | 106.5 | |||||
| 2 | E | 32.8 | Very low | 35.4 | Very low | 191 Ų | 191 | 156.8 Ų | 156.8 | 89% | 0.893 | 80% | 0.803 | S | S | * | * | trans | -73.3 | 174 | -168.8 | -69.3 | 125.2 | 122 | 0 | 0 | 115 | ||||
| 3 | A | 49.6 | Very low | 34.9 | Very low | 77 Ų | 77 | 155.5 Ų | 155.5 | 64% | 0.636 | 80% | 0.798 | S | S | * | * | trans | -75.9 | -173.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | E5 | A3-E5 HydrophobicContact CB-CG 4.24Š| ||
| 4 | P | 57.8 | Low | 34.5 | Very low | 119 Ų | 119 | 156.9 Ų | 156.9 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | -119.7 | 152.5 | 71.2 | 4.7 | 18.2 | 0 | 0 | 0 | 112.2 | |||||
| 5 | E | 41.8 | Very low | 34 | Very low | 145 Ų | 145 | 152.4 Ų | 152.4 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | cis | 89.9 | 150.4 | 40.7 | -72 | -163.5 | 146.6 | 0 | 0 | 115.9 | A3 | A3-E5 HydrophobicContact CB-CG 4.24Š| ||
| 6 | Y | 31.5 | Very low | 33.6 | Very low | 185 Ų | 185 | 151.7 Ų | 151.7 | 73% | 0.725 | 78% | 0.783 | S | S | * | * | trans | 84.3 | 107 | -179.6 | -66.3 | -89.7 | 0 | 0 | 0 | 116.2 | ||||
| 7 | L | 34.1 | Very low | 33.3 | Very low | 121 Ų | 121 | 152.1 Ų | 152.1 | 63% | 0.634 | 79% | 0.787 | S | S | * | * | cis | 71.1 | 134.8 | 44.2 | -52.3 | 167.8 | 0 | 0 | 0 | 111.6 | ||||
| 8 | D | 30.2 | Very low | 32.9 | Very low | 126 Ų | 126 | 151.6 Ų | 151.6 | 67% | 0.674 | 78% | 0.784 | S | S | * | * | cis | -152.2 | 166.8 | 2.5 | -96.1 | -35.6 | 0 | 0 | 0 | 110 | ||||
| 9 | L | 29.5 | Very low | 32.5 | Very low | 170 Ų | 170 | 148.7 Ų | 148.7 | 89% | 0.89 | 78% | 0.778 | S | S | * | * | 173.1 | 152.1 | 120.6 | -92 | 168.7 | 0 | 0 | 0 | 113.7 | |||||
| 10 | D | 30 | Very low | 32.2 | Very low | 148 Ų | 148 | 147.4 Ų | 147.4 | 79% | 0.791 | 77% | 0.772 | S | S | * | * | trans | -91.3 | -170.6 | -172.8 | -73.4 | -69.4 | 0 | 0 | 0 | 115 | ||||
| 11 | E | 28.9 | Very low | 32 | Very low | 191 Ų | 191 | 147 Ų | 147 | 89% | 0.893 | 77% | 0.77 | S | S | * | * | trans | 81.7 | 107.9 | 167.9 | -59.7 | -165.5 | 130.2 | 0 | 0 | 118 | ||||
| 12 | I | 30.4 | Very low | 31.9 | Very low | 169 Ų | 169 | 147.4 Ų | 147.4 | 87% | 0.867 | 76% | 0.759 | S | S | * | * | trans | -130.3 | 119 | 155.7 | -62 | 174.9 | 0 | 0 | 0 | 106.3 | ||||
| 13 | D | 27.9 | Very low | 31.6 | Very low | 140 Ų | 140 | 143 Ų | 143 | 75% | 0.749 | 75% | 0.749 | S | S | * | * | trans | -152.5 | 148.1 | 156.3 | -140.3 | 16 | 0 | 0 | 0 | 113.6 | ||||
| 14 | F | 29.2 | Very low | 30.7 | Very low | 175 Ų | 175 | 147.8 Ų | 147.8 | 77% | 0.768 | 76% | 0.759 | S | S | * | * | trans | 5.3 | 121.2 | 176.1 | -73.7 | -76.5 | 0 | 0 | 0 | 123.3 | ||||
| 15 | S | 27.1 | Very low | 29.3 | Very low | 90 Ų | 90 | 145.8 Ų | 145.8 | 63% | 0.629 | 76% | 0.76 | S | S | * | * | 127.7 | 143.8 | 100 | -107.2 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 16 | D | 28.2 | Very low | 28.6 | Very low | 141 Ų | 141 | 145.4 Ų | 145.4 | 75% | 0.754 | 76% | 0.762 | S | S | * | * | trans | 75.6 | 93.6 | 140.6 | -61 | 9.6 | 0 | 0 | 0 | 122.4 | ||||
| 17 | D | 27.9 | Very low | 28.4 | Very low | 159 Ų | 159 | 146.8 Ų | 146.8 | 85% | 0.85 | 77% | 0.766 | S | S | * | * | 86.2 | 170.9 | 119.2 | -129 | -20 | 0 | 0 | 0 | 121.5 | |||||
| 18 | I | 26.5 | Very low | 28.2 | Very low | 143 Ų | 143 | 146.8 Ų | 146.8 | 73% | 0.733 | 77% | 0.766 | S | S | * | * | trans | 87.7 | 81 | 171.4 | -47.5 | -173.9 | 0 | 0 | 0 | 118.6 | ||||
| 19 | S | 26.3 | Very low | 28.1 | Very low | 96 Ų | 96 | 148.9 Ų | 148.9 | 67% | 0.671 | 77% | 0.772 | S | S | * | * | 71.1 | 160.4 | 119.6 | 92.2 | 0 | 0 | 0 | 0 | 125.6 | |||||
| 20 | D | 26.5 | Very low | 28.1 | Very low | 123 Ų | 123 | 148.7 Ų | 148.7 | 66% | 0.658 | 76% | 0.764 | S | S | * | * | trans | 83.3 | 91.4 | 153.7 | -74.8 | -67.3 | 0 | 0 | 0 | 124 | ||||
| 21 | N | 26.3 | Very low | 27.9 | Very low | 138 Ų | 138 | 149.1 Ų | 149.1 | 74% | 0.738 | 77% | 0.765 | S | S | * | * | 51.5 | 98.6 | 112.2 | -75.6 | -55.9 | 0 | 0 | 0 | 120.1 | |||||
| 22 | R | 26.9 | Very low | 27.8 | Very low | 248 Ų | 248 | 142.7 Ų | 142.7 | 94% | 0.936 | 75% | 0.751 | S | S | * | * | trans | -174.1 | 147.7 | 137.1 | -101.5 | 154.2 | -163.3 | -143.4 | 6.3 | 109.5 | ||||
| 23 | S | 27.2 | Very low | 27.6 | Very low | 98 Ų | 98 | 142 Ų | 142 | 69% | 0.685 | 75% | 0.748 | S | S | * | * | cis | -159.9 | 162.4 | -7.9 | -154 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 24 | Q | 30.3 | Very low | 27.5 | Very low | 179 Ų | 179 | 143.4 Ų | 143.4 | 84% | 0.836 | 75% | 0.75 | S | S | * | * | trans | 52.5 | 92.2 | 163.1 | -55 | -158.2 | -3.7 | 0 | 0 | 118.9 | ||||
| 25 | G | 28.1 | Very low | 27.3 | Very low | 77 Ų | 77 | 142 Ų | 142 | 79% | 0.794 | 75% | 0.75 | S | S | * | * | trans | -89.1 | 155 | 147.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 26 | N | 27.6 | Very low | 27.4 | Very low | 136 Ų | 136 | 143.3 Ų | 143.3 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | trans | -142.7 | 125.7 | 168.3 | -119.9 | -39 | 0 | 0 | 0 | 110.7 | ||||
| 27 | R | 28.5 | Very low | 27.2 | Very low | 214 Ų | 214 | 143.1 Ų | 143.1 | 81% | 0.808 | 75% | 0.754 | S | S | * | * | trans | 33.8 | 134.4 | 132.1 | -73.6 | -175.6 | 159.8 | -158.9 | -6 | 119.2 | ||||
| 28 | L | 28.9 | Very low | 27.2 | Very low | 122 Ų | 122 | 144.8 Ų | 144.8 | 64% | 0.639 | 75% | 0.748 | S | S | * | * | cis | -154.8 | 152.1 | 9.8 | -91.8 | 146.6 | 0 | 0 | 0 | 107.5 | ||||
| 29 | Q | 27.2 | Very low | 27.2 | Very low | 169 Ų | 169 | 144.9 Ų | 144.9 | 79% | 0.79 | 75% | 0.745 | S | S | * | * | 39.1 | 144.2 | 89.2 | -70.4 | -170 | 7.7 | 0 | 0 | 116.7 | |||||
| 30 | K | 29.5 | Very low | 27.2 | Very low | 166 Ų | 166 | 147.4 Ų | 147.4 | 72% | 0.722 | 75% | 0.751 | S | S | * | * | cis | -178.6 | 160 | -14.5 | -168.8 | -165.4 | 176.1 | -169 | 0 | 107.3 | ||||
| 31 | L | 26.9 | Very low | 27.4 | Very low | 157 Ų | 157 | 145.8 Ų | 145.8 | 82% | 0.822 | 76% | 0.755 | S | S | * | * | trans | 72.7 | 155.8 | 169 | -48.1 | 175.4 | 0 | 0 | 0 | 115.5 | ||||
| 32 | G | 26 | Very low | 27.5 | Very low | 57 Ų | 57 | 147.2 Ų | 147.2 | 59% | 0.588 | 76% | 0.762 | S | S | * | * | cis | 166 | 171.6 | -7.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 33 | L | 26.5 | Very low | 27.6 | Very low | 155 Ų | 155 | 138.8 Ų | 138.8 | 81% | 0.812 | 75% | 0.752 | S | S | * | * | trans | 66.3 | 141.4 | -174.4 | -64.7 | 97.9 | 0 | 0 | 0 | 115.4 | ||||
| 34 | E | 26.6 | Very low | 27.7 | Very low | 169 Ų | 169 | 143.7 Ų | 143.7 | 79% | 0.79 | 76% | 0.762 | S | S | * | * | cis | 120.5 | 167 | 10.7 | -78.4 | 174.6 | 127 | 0 | 0 | 112.5 | ||||
| 35 | D | 24.7 | Very low | 27.5 | Very low | 144 Ų | 144 | 138.7 Ų | 138.7 | 77% | 0.77 | 76% | 0.758 | S | S | * | * | trans | 73.6 | 96.1 | -171.8 | -54.9 | -12.6 | 0 | 0 | 0 | 114.9 | ||||
| 36 | T | 28.3 | Very low | 27.5 | Very low | 119 Ų | 119 | 144.8 Ų | 144.8 | 73% | 0.73 | 76% | 0.763 | S | S | * | * | cis | 79.7 | 106.3 | 47 | 75.6 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 37 | D | 25.4 | Very low | 27.6 | Very low | 136 Ų | 136 | 147.2 Ų | 147.2 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | trans | 172.5 | 147.6 | 144.6 | -102.1 | -17.2 | 0 | 0 | 0 | 108.6 | ||||
| 38 | R | 27.5 | Very low | 27.6 | Very low | 194 Ų | 194 | 148.7 Ų | 148.7 | 73% | 0.732 | 78% | 0.775 | S | S | * | * | cis | -170.7 | 168.7 | -14.4 | -150.1 | -178.2 | 168.1 | 95.2 | 2.7 | 112.1 | ||||
| 39 | E | 26.2 | Very low | 27.6 | Very low | 145 Ų | 145 | 147.8 Ų | 147.8 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | trans | 85 | 143.2 | 157.7 | -61.4 | -61.4 | 128 | 0 | 0 | 120.2 | ||||
| 40 | D | 27.2 | Very low | 27.9 | Very low | 149 Ų | 149 | 146.9 Ų | 146.9 | 80% | 0.797 | 78% | 0.778 | S | S | * | * | trans | -96.7 | 169.6 | -173.9 | -60.4 | -90.4 | 0 | 0 | 0 | 113.4 | ||||
| 41 | A | 29.6 | Very low | 28.1 | Very low | 90 Ų | 90 | 146.8 Ų | 146.8 | 74% | 0.744 | 79% | 0.785 | S | S | * | * | -178.6 | 113.4 | 123.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 42 | L | 29.4 | Very low | 28.2 | Very low | 167 Ų | 167 | 145.2 Ų | 145.2 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | 34.8 | 115.5 | 130.1 | -58.1 | 171.9 | 0 | 0 | 0 | 119.9 | ||||
| 43 | G | 27.4 | Very low | 28.9 | Very low | 71 Ų | 71 | 148.4 Ų | 148.4 | 73% | 0.732 | 79% | 0.79 | S | S | * | * | trans | -96.1 | 156.3 | 158 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 44 | F | 29.4 | Very low | 29.3 | Very low | 202 Ų | 202 | 147.4 Ų | 147.4 | 89% | 0.886 | 79% | 0.79 | S | S | * | * | trans | -146.7 | 135.5 | 162.4 | -107.4 | -80.9 | 0 | 0 | 0 | 110.1 | ||||
| 45 | G | 26.9 | Very low | 29.7 | Very low | 73 Ų | 73 | 143.9 Ų | 143.9 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | trans | -84.6 | 152.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 46 | F | 27.5 | Very low | 30 | Very low | 206 Ų | 206 | 141.7 Ų | 141.7 | 90% | 0.904 | 79% | 0.791 | S | S | * | * | trans | -122.9 | 114.5 | 174.4 | -102.3 | -88.4 | 0 | 0 | 0 | 112 | ||||
| 47 | H | 30.8 | Very low | 30.2 | Very low | 186 Ų | 186 | 142.7 Ų | 142.7 | 86% | 0.861 | 79% | 0.792 | S | S | * | * | trans | -84.2 | 161.9 | 158.2 | -118.3 | -26 | 0 | 0 | 0 | 109.7 | ||||
| 48 | R | 28.6 | Very low | 30.4 | Very low | 246 Ų | 246 | 140.3 Ų | 140.3 | 93% | 0.928 | 80% | 0.799 | S | S | * | * | trans | 80.6 | 83.5 | 163.3 | -163.7 | -171.8 | -172.9 | 167.9 | 3.8 | 117.7 | ||||
| 49 | A | 29 | Very low | 30.6 | Very low | 102 Ų | 102 | 135.9 Ų | 135.9 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | trans | -141.9 | 117.8 | 146.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 50 | K | 32.8 | Very low | 30.6 | Very low | 151 Ų | 151 | 134.8 Ų | 134.8 | 66% | 0.657 | 81% | 0.811 | S | S | * | * | trans | -131.5 | 153.6 | 152.8 | -85.9 | -151.7 | 173.4 | -157.6 | 0 | 107 | ||||
| 51 | L | 32.8 | Very low | 30.6 | Very low | 164 Ų | 164 | 136 Ų | 136 | 86% | 0.859 | 81% | 0.811 | S | S | * | * | trans | 63.4 | 78.1 | -167.1 | -74.6 | 74.2 | 0 | 0 | 0 | 114.4 | ||||
| 52 | T | 29.8 | Very low | 30.4 | Very low | 124 Ų | 124 | 137.4 Ų | 137.4 | 76% | 0.761 | 81% | 0.814 | S | S | * | * | trans | -153.7 | 94 | 130.3 | -65.3 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 53 | V | 41.5 | Very low | 30.7 | Very low | 124 Ų | 124 | 135.1 Ų | 135.1 | 75% | 0.752 | 81% | 0.809 | S | S | * | * | trans | -69.9 | 147.5 | 160.5 | 178.8 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 54 | V | 35 | Very low | 30.7 | Very low | 133 Ų | 133 | 140.8 Ų | 140.8 | 81% | 0.806 | 82% | 0.817 | S | S | * | * | S | Bend | trans | 74.6 | 70.1 | -169.5 | -163.8 | 0 | 0 | 0 | 0 | 114.4 | ||
| 55 | A | 34.6 | Very low | 30.6 | Very low | 95 Ų | 95 | 137.9 Ų | 137.9 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | trans | 179.3 | 58 | 140.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 56 | A | 29.5 | Very low | 30.6 | Very low | 98 Ų | 98 | 143.5 Ų | 143.5 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | trans | -144.6 | 42.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 57 | L | 34.3 | Very low | 30.6 | Very low | 141 Ų | 141 | 143.3 Ų | 143.3 | 74% | 0.738 | 81% | 0.812 | S | S | * | * | trans | -129.9 | 101 | 167 | -76.8 | 175 | 0 | 0 | 0 | 109.4 | ||||
| 58 | G | 29.2 | Very low | 30.4 | Very low | 85 Ų | 85 | 140.3 Ų | 140.3 | 88% | 0.876 | 81% | 0.812 | S | S | * | * | trans | 172.2 | 36.6 | -174.3 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 59 | A | 31.6 | Very low | 30.3 | Very low | 101 Ų | 101 | 134.6 Ų | 134.6 | 84% | 0.835 | 80% | 0.804 | S | S | * | * | trans | -149.5 | 41.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 60 | C | 26.1 | Very low | 30.3 | Very low | 123 Ų | 123 | 136.3 Ų | 136.3 | 83% | 0.831 | 80% | 0.804 | S | S | * | * | trans | -127 | 117.5 | 166.2 | -59.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 61 | H | 27.4 | Very low | 30.1 | Very low | 174 Ų | 174 | 134.8 Ų | 134.8 | 81% | 0.806 | 81% | 0.813 | S | S | * | * | trans | -134.3 | 111.3 | 169.6 | -106.6 | 36.4 | 0 | 0 | 0 | 108.5 | ||||
| 62 | C | 25.5 | Very low | 30.1 | Very low | 119 Ų | 119 | 134.4 Ų | 134.4 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 128.6 | 163.7 | -58.8 | 0 | 0 | 0 | 0 | 107.8 | ||
| 63 | P | 35 | Very low | 30.3 | Very low | 119 Ų | 119 | 137.4 Ų | 137.4 | 77% | 0.773 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 122.2 | 168.8 | 30.9 | -30.6 | 0 | 0 | 0 | 109.8 | ||
| 64 | E | 27.7 | Very low | 29.6 | Very low | 191 Ų | 191 | 137.6 Ų | 137.6 | 89% | 0.893 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 143.4 | 163.5 | -67.3 | 177.4 | 134 | 0 | 0 | 109.2 | ||
| 65 | N | 27.3 | Very low | 29.5 | Very low | 140 Ų | 140 | 138.8 Ų | 138.8 | 75% | 0.749 | 82% | 0.815 | S | S | * | * | trans | -111.8 | 101.8 | -173.8 | -122.3 | 20.5 | 0 | 0 | 0 | 109.6 | ||||
| 66 | E | 26.9 | Very low | 30.1 | Very low | 191 Ų | 191 | 139.2 Ų | 139.2 | 89% | 0.893 | 81% | 0.81 | S | S | * | * | trans | -107.4 | 123.7 | 164 | -72.3 | -162.9 | 136 | 0 | 0 | 109.9 | ||||
| 67 | Y | 28.2 | Very low | 30 | Very low | 202 Ų | 202 | 143.7 Ų | 143.7 | 79% | 0.792 | 81% | 0.814 | S | S | * | * | trans | -129 | 118.2 | 172.1 | -88.9 | -78.7 | 0 | 0 | 0 | 110.4 | ||||
| 68 | S | 25.2 | Very low | 29.8 | Very low | 123 Ų | 123 | 144 Ų | 144 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | trans | -106.1 | 151.2 | 167.3 | 56.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 69 | V | 27.2 | Very low | 29.8 | Very low | 127 Ų | 127 | 145 Ų | 145 | 77% | 0.77 | 81% | 0.808 | S | S | * | * | trans | -109.4 | 170.1 | -158.5 | -179.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 70 | T | 28.7 | Very low | 29.7 | Very low | 137 Ų | 137 | 149.9 Ų | 149.9 | 84% | 0.84 | 81% | 0.805 | S | S | * | * | trans | 93.6 | 147.9 | 169.6 | 78.6 | 0 | 0 | 0 | 0 | 116 | ||||
| 71 | S | 28.5 | Very low | 29.6 | Very low | 119 Ų | 119 | 154.3 Ų | 154.3 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | cis | -139.7 | -147.9 | 6 | 76 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 72 | L | 34 | Very low | 29.6 | Very low | 156 Ų | 156 | 150.9 Ų | 150.9 | 82% | 0.817 | 80% | 0.799 | S | S | * | * | trans | -127.3 | 165.2 | -150.6 | -84.5 | 162.2 | 0 | 0 | 0 | 116.7 | ||||
| 73 | K | 32.3 | Very low | 29.7 | Very low | 187 Ų | 187 | 151.5 Ų | 151.5 | 81% | 0.813 | 79% | 0.794 | S | S | * | * | trans | 77.2 | 153.7 | 165.5 | -67 | 170.4 | 178.1 | 175.2 | 0 | 116.2 | ||||
| 74 | T | 28.5 | Very low | 29.2 | Very low | 128 Ų | 128 | 151.3 Ų | 151.3 | 79% | 0.785 | 79% | 0.79 | S | S | * | * | cis | -148.3 | 163.8 | 17.5 | -25.9 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 75 | I | 30.9 | Very low | 29.2 | Very low | 158 Ų | 158 | 151.6 Ų | 151.6 | 81% | 0.81 | 79% | 0.792 | S | S | * | * | trans | -155.2 | 174.5 | 179.6 | 53.4 | 166.6 | 0 | 0 | 0 | 109.4 | ||||
| 76 | P | 48.6 | Very low | 29.1 | Very low | 105 Ų | 105 | 151.5 Ų | 151.5 | 68% | 0.682 | 79% | 0.791 | S | S | * | * | cis | -128 | -170.1 | -9.8 | 43.3 | -28.5 | 0 | 0 | 0 | 113.6 | ||||
| 77 | E | 26.8 | Very low | 29.1 | Very low | 192 Ų | 192 | 149.6 Ų | 149.6 | 90% | 0.897 | 78% | 0.783 | S | S | * | * | trans | -153.3 | 177.9 | 137.6 | -124.5 | -178.6 | -162.9 | 0 | 0 | 114.3 | ||||
| 78 | L | 29.3 | Very low | 28.9 | Very low | 148 Ų | 148 | 147 Ų | 147 | 78% | 0.775 | 78% | 0.783 | S | S | * | * | trans | -144.6 | 179.6 | -150.8 | -75.4 | 169.6 | 0 | 0 | 0 | 115.5 | ||||
| 79 | C | 29.6 | Very low | 28.9 | Very low | 105 Ų | 105 | 151.5 Ų | 151.5 | 71% | 0.709 | 78% | 0.78 | S | S | * | * | trans | 85.1 | 150.7 | 163.2 | -70.1 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 80 | R | 29.3 | Very low | 28.8 | Very low | 203 Ų | 203 | 149.9 Ų | 149.9 | 77% | 0.766 | 78% | 0.775 | S | S | * | * | cis | -163.5 | 156.6 | 6.1 | -123.3 | 162.5 | -161.2 | 171.4 | 5.4 | 111.4 | ||||
| 81 | R | 25.3 | Very low | 28.7 | Very low | 216 Ų | 216 | 149.6 Ų | 149.6 | 82% | 0.815 | 77% | 0.773 | S | S | * | * | trans | 34.1 | 152.3 | 138.1 | -69.8 | -178 | 178.8 | 176.3 | -3.1 | 120.3 | ||||
| 82 | C | 27.5 | Very low | 28.8 | Very low | 103 Ų | 103 | 149 Ų | 149 | 70% | 0.696 | 77% | 0.768 | S | S | * | * | cis | -173.8 | -173.2 | 1.6 | -109 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 83 | D | 26.1 | Very low | 28.4 | Very low | 132 Ų | 132 | 146.7 Ų | 146.7 | 71% | 0.706 | 77% | 0.765 | S | S | * | * | cis | -145.1 | -116.6 | 6.2 | -151.9 | -91.2 | 0 | 0 | 0 | 113.5 | ||||
| 84 | T | 25 | Very low | 28.3 | Very low | 114 Ų | 114 | 143.2 Ų | 143.2 | 70% | 0.699 | 76% | 0.764 | S | S | * | * | trans | -139.2 | 154.4 | -172.4 | 52.6 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 85 | Q | 27.2 | Very low | 28.2 | Very low | 197 Ų | 197 | 141.6 Ų | 141.6 | 92% | 0.921 | 76% | 0.759 | S | S | * | * | -179.6 | -170.5 | 126.1 | -100 | -170.8 | -11 | 0 | 0 | 113.9 | |||||
| 86 | N | 26.3 | Very low | 27.8 | Very low | 138 Ų | 138 | 145.1 Ų | 145.1 | 74% | 0.738 | 76% | 0.762 | S | S | * | * | trans | -138.2 | 179.3 | -144.6 | -156.2 | 49.2 | 0 | 0 | 0 | 114.1 | ||||
| 87 | E | 26.5 | Very low | 26.6 | Very low | 152 Ų | 152 | 146.3 Ų | 146.3 | 71% | 0.71 | 76% | 0.763 | S | S | * | * | trans | 75.1 | 98.6 | 164.5 | -59.2 | -75.5 | 117.3 | 0 | 0 | 120.4 | ||||
| 88 | D | 23.8 | Very low | 26.5 | Very low | 148 Ų | 148 | 143.5 Ų | 143.5 | 79% | 0.791 | 76% | 0.762 | S | S | * | * | 58.7 | 155.7 | 111.8 | -122.6 | -47 | 0 | 0 | 0 | 126 | |||||
| 89 | R | 26.2 | Very low | 26.2 | Very low | 216 Ų | 216 | 139.8 Ų | 139.8 | 82% | 0.815 | 76% | 0.76 | S | S | * | * | trans | 91.3 | 72.4 | 146.4 | -144.9 | 170.6 | -160.4 | 154.6 | 7.6 | 124 | ||||
| 90 | S | 25.5 | Very low | 26 | Very low | 93 Ų | 93 | 142.5 Ų | 142.5 | 65% | 0.65 | 77% | 0.766 | S | S | * | * | 41 | 158 | 113.4 | 72.2 | 0 | 0 | 0 | 0 | 124.9 | |||||
| 91 | V | 25.8 | Very low | 25.7 | Very low | 132 Ų | 132 | 137.5 Ų | 137.5 | 80% | 0.8 | 76% | 0.762 | S | S | * | * | trans | 97.1 | 142.3 | 158.4 | 179.5 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 92 | S | 29.5 | Very low | 26.1 | Very low | 105 Ų | 105 | 132.5 Ų | 132.5 | 73% | 0.734 | 76% | 0.756 | S | S | * | * | cis | 179 | 165.1 | -31 | -80.9 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 93 | S | 26.3 | Very low | 26.2 | Very low | 108 Ų | 108 | 134.7 Ų | 134.7 | 76% | 0.755 | 76% | 0.76 | S | S | * | * | trans | -165.5 | 143.9 | 138.6 | 57.2 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 94 | S | 30.8 | Very low | 26.3 | Very low | 114 Ų | 114 | 135.3 Ų | 135.3 | 80% | 0.797 | 76% | 0.762 | S | S | * | * | trans | 57 | 147.7 | 147.5 | -59 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 95 | S | 25.4 | Very low | 26.3 | Very low | 95 Ų | 95 | 135.4 Ų | 135.4 | 66% | 0.664 | 76% | 0.762 | S | S | * | * | cis | -172 | 134.3 | -16.3 | 50.2 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 96 | W | 23.3 | Very low | 26.2 | Very low | 231 Ų | 231 | 132.8 Ų | 132.8 | 88% | 0.875 | 75% | 0.754 | S | S | * | * | trans | 64.2 | 118.9 | 140.8 | -73 | 59.9 | 0 | 0 | 0 | 123.8 | ||||
| 97 | N | 24.1 | Very low | 26.2 | Very low | 131 Ų | 131 | 131.2 Ų | 131.2 | 70% | 0.701 | 75% | 0.75 | S | S | * | * | trans | 78 | 112.3 | 131.3 | -76.2 | 12.1 | 0 | 0 | 0 | 125.8 | ||||
| 98 | C | 23.3 | Very low | 26.2 | Very low | 132 Ų | 132 | 132.6 Ų | 132.6 | 89% | 0.892 | 76% | 0.756 | S | S | * | * | 82.6 | 122.6 | 119.4 | -156.3 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 99 | G | 23.5 | Very low | 26.4 | Very low | 71 Ų | 71 | 135.1 Ų | 135.1 | 73% | 0.732 | 76% | 0.76 | S | S | * | * | trans | 170.2 | 87 | 170.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 100 | I | 24.6 | Very low | 27.5 | Very low | 162 Ų | 162 | 130.1 Ų | 130.1 | 83% | 0.831 | 76% | 0.756 | S | S | * | * | trans | -3 | 117.1 | 158 | -63.7 | 167.8 | 0 | 0 | 0 | 116.7 | ||||
| 101 | S | 24.7 | Very low | 27.7 | Very low | 97 Ų | 97 | 132.5 Ų | 132.5 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | 73.8 | 147.4 | 81.8 | -125.7 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 102 | T | 32.3 | Very low | 27.9 | Very low | 111 Ų | 111 | 129.3 Ų | 129.3 | 68% | 0.681 | 76% | 0.761 | S | S | * | * | cis | -146.2 | 134.2 | 18.3 | 45.1 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 103 | L | 29.3 | Very low | 28.1 | Very low | 150 Ų | 150 | 132.9 Ų | 132.9 | 79% | 0.785 | 77% | 0.769 | S | S | * | * | 60.2 | 164.2 | 120.5 | -51.7 | 172.9 | 0 | 0 | 0 | 120 | |||||
| 104 | I | 29.2 | Very low | 28.5 | Very low | 145 Ų | 145 | 131.1 Ų | 131.1 | 74% | 0.744 | 76% | 0.761 | S | S | * | * | cis | -146.5 | 136 | 32.1 | -72.3 | 173.2 | 0 | 0 | 0 | 112.6 | ||||
| 105 | T | 25.6 | Very low | 28.6 | Very low | 115 Ų | 115 | 132.8 Ų | 132.8 | 71% | 0.706 | 76% | 0.762 | S | S | * | * | trans | 22.2 | 141 | 159.3 | 62.9 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 106 | N | 24.2 | Very low | 29.2 | Very low | 142 Ų | 142 | 134.1 Ų | 134.1 | 76% | 0.759 | 77% | 0.765 | S | S | * | * | cis | 57.9 | 96.2 | 12 | -168.6 | 22.3 | 0 | 0 | 0 | 118.2 | ||||
| 107 | T | 26.5 | Very low | 29.9 | Very low | 105 Ų | 105 | 131.4 Ų | 131.4 | 64% | 0.644 | 76% | 0.756 | S | S | * | * | -177.9 | 133.3 | 122.5 | 31.6 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 108 | Q | 27.3 | Very low | 30.4 | Very low | 182 Ų | 182 | 128.8 Ų | 128.8 | 85% | 0.85 | 75% | 0.748 | S | S | * | * | trans | 61.6 | 148.2 | 134.7 | -69.4 | 157.1 | -25.3 | 0 | 0 | 125.6 | ||||
| 109 | K | 28 | Very low | 30.8 | Very low | 200 Ų | 200 | 131.4 Ų | 131.4 | 87% | 0.87 | 74% | 0.744 | S | S | * | * | trans | -79.8 | -176.8 | 178.1 | -53.4 | 180 | 180 | 179.5 | 0 | 111 | ||||
| 110 | P | 48.8 | Very low | 31.3 | Very low | 111 Ų | 111 | 134.8 Ų | 134.8 | 72% | 0.721 | 74% | 0.739 | S | S | * | * | cis | -147.2 | -160.5 | 16.8 | 42.4 | -18.6 | 0 | 0 | 0 | 117.6 | ||||
| 111 | T | 29.6 | Very low | 31.9 | Very low | 144 Ų | 144 | 137 Ų | 137 | 88% | 0.883 | 74% | 0.737 | S | S | * | * | trans | 76 | 128.8 | 176.2 | 68.9 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 112 | G | 29.9 | Very low | 32.6 | Very low | 65 Ų | 65 | 138.1 Ų | 138.1 | 67% | 0.67 | 74% | 0.742 | S | S | * | * | cis | 164.6 | 156.6 | -12.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 113 | I | 34.4 | Very low | 32.7 | Very low | 179 Ų | 179 | 139.5 Ų | 139.5 | 92% | 0.918 | 75% | 0.75 | S | S | * | * | trans | 66.2 | 132.1 | 161 | -52.2 | 171.5 | 0 | 0 | 0 | 116.4 | ||||
| 114 | A | 34 | Very low | 32.7 | Very low | 71 Ų | 71 | 141.6 Ų | 141.6 | 59% | 0.587 | 75% | 0.753 | S | S | * | * | cis | -168.9 | 155 | -21.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 115 | D | 32.7 | Very low | 33.3 | Very low | 150 Ų | 150 | 146.2 Ų | 146.2 | 80% | 0.802 | 76% | 0.761 | S | S | * | * | trans | 51.8 | 159.2 | 138.5 | -57.5 | -17.1 | 0 | 0 | 0 | 121.4 | ||||
| 116 | V | 37.8 | Very low | 33.4 | Very low | 122 Ų | 122 | 147.5 Ų | 147.5 | 74% | 0.739 | 77% | 0.768 | S | S | * | * | cis | -163.1 | 158.1 | -3.7 | 109.3 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 117 | Y | 37.6 | Very low | 33.8 | Very low | 175 Ų | 175 | 146.2 Ų | 146.2 | 69% | 0.686 | 77% | 0.77 | S | S | * | * | cis | -157.4 | 155.2 | -24.6 | -123.9 | -139 | 0 | 0 | 0 | 104.3 | ||||
| 118 | S | 34.5 | Very low | 35.2 | Very low | 76 Ų | 76 | 146.8 Ų | 146.8 | 53% | 0.531 | 78% | 0.776 | S | S | . | * | cis | 84.6 | 93.4 | 25.4 | -160.2 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 119 | K | 32.9 | Very low | 35.1 | Very low | 187 Ų | 187 | 146.5 Ų | 146.5 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | trans | -160 | 108.8 | 154.6 | -96.5 | 146.3 | -171.4 | -178.9 | 0 | 109.5 | ||||
| 120 | F | 34.1 | Very low | 35.1 | Very low | 142 Ų | 142 | 145.5 Ų | 145.5 | 62% | 0.623 | 78% | 0.775 | S | S | * | * | 74.9 | 132.3 | 67.5 | -71.1 | -61.6 | 0 | 0 | 0 | 112.9 | |||||
| 121 | R | 36.5 | Very low | 34.1 | Very low | 207 Ų | 207 | 149.4 Ų | 149.4 | 78% | 0.781 | 78% | 0.783 | S | S | * | * | cis | -171.1 | 161.2 | -21.4 | -121.2 | -172 | -156.3 | -161.5 | 4.5 | 107.7 | ||||
| 122 | P | 40.4 | Very low | 34.1 | Very low | 122 Ų | 122 | 150.6 Ų | 150.6 | 79% | 0.792 | 78% | 0.779 | S | S | * | * | trans | -80.8 | 150.9 | 177.7 | 33.5 | -33.3 | 0 | 0 | 0 | 112.8 | ||||
| 123 | V | 32.8 | Very low | 34.4 | Very low | 139 Ų | 139 | 152.7 Ų | 152.7 | 84% | 0.842 | 78% | 0.78 | S | S | * | * | trans | -135.9 | 140.3 | 179.5 | -178.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 124 | K | 29.6 | Very low | 33.9 | Very low | 195 Ų | 195 | 152.1 Ų | 152.1 | 85% | 0.848 | 77% | 0.774 | S | S | * | * | trans | -80.6 | 130.3 | -175.8 | -172.2 | 176.8 | -176.3 | 177.6 | 0 | 111.2 | ||||
| 125 | R | 42.2 | Very low | 33.4 | Very low | 242 Ų | 242 | 154 Ų | 154 | 91% | 0.913 | 78% | 0.778 | S | S | * | * | trans | -85.7 | 151.9 | 175.6 | -70.3 | -176.6 | 179.5 | 139.2 | -0.4 | 112.3 | ||||
| 126 | V | 28.6 | Very low | 33.3 | Very low | 141 Ų | 141 | 153.7 Ų | 153.7 | 86% | 0.855 | 78% | 0.776 | S | S | * | * | trans | -147.2 | 161.4 | 168.2 | -96.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 127 | S | 30.7 | Very low | 32.7 | Very low | 115 Ų | 115 | 157.3 Ų | 157.3 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | -165.8 | 170.5 | -170.9 | -70.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 128 | P | 56.5 | Low | 32 | Very low | 118 Ų | 118 | 155.4 Ų | 155.4 | 77% | 0.766 | 79% | 0.786 | S | S | * | * | cis | -128.9 | 178.7 | -36.6 | 37.1 | -22.9 | 0 | 0 | 0 | 111.5 | ||||
| 129 | L | 26 | Very low | 31.6 | Very low | 175 Ų | 175 | 157.3 Ų | 157.3 | 92% | 0.916 | 79% | 0.791 | S | S | * | * | trans | -159.9 | 165.3 | 154.2 | -112.5 | 157.4 | 0 | 0 | 0 | 112.8 | ||||
| 130 | K | 26.7 | Very low | 31.4 | Very low | 179 Ų | 179 | 155.6 Ų | 155.6 | 78% | 0.778 | 79% | 0.785 | S | S | * | * | trans | -86.5 | 156.8 | -162.7 | -57 | 174.1 | 178.5 | 179.2 | 0 | 113.5 | ||||
| 131 | H | 28.9 | Very low | 31.1 | Very low | 193 Ų | 193 | 153.3 Ų | 153.3 | 89% | 0.894 | 79% | 0.787 | S | S | * | * | -169.2 | 144.9 | 114.5 | -99.2 | -65.7 | 0 | 0 | 0 | 113.7 | |||||
| 132 | Q | 28.7 | Very low | 30.7 | Very low | 170 Ų | 170 | 150.4 Ų | 150.4 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | trans | -111.1 | 158.4 | 153.2 | -130.6 | 179.7 | 3.3 | 0 | 0 | 105.8 | ||||
| 133 | P | 37 | Very low | 30.1 | Very low | 108 Ų | 108 | 150.1 Ų | 150.1 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | -153.8 | 172.4 | 74.4 | 43.4 | -23.8 | 0 | 0 | 0 | 117.4 | |||||
| 134 | E | 23.6 | Very low | 29.9 | Very low | 167 Ų | 167 | 151 Ų | 151 | 78% | 0.78 | 77% | 0.774 | S | S | * | * | 21.1 | 150.1 | 129.6 | -57 | 177.8 | 163.1 | 0 | 0 | 120.8 | |||||
| 135 | T | 24.5 | Very low | 29.9 | Very low | 111 Ų | 111 | 150.3 Ų | 150.3 | 68% | 0.681 | 77% | 0.771 | S | S | * | * | cis | -167.5 | 166.7 | 4.4 | 13.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 136 | L | 29.2 | Very low | 29.1 | Very low | 143 Ų | 143 | 146.2 Ų | 146.2 | 75% | 0.749 | 77% | 0.767 | S | S | * | * | trans | 39.7 | 128.5 | 145.6 | -69 | 162.1 | 0 | 0 | 0 | 121.8 | ||||
| 137 | E | 25.3 | Very low | 29.1 | Very low | 199 Ų | 199 | 147.1 Ų | 147.1 | 93% | 0.93 | 76% | 0.762 | S | S | * | * | -143.9 | 169.1 | 115 | -81.3 | -143 | 127.8 | 0 | 0 | 109.2 | |||||
| 138 | N | 23.9 | Very low | 28.9 | Very low | 135 Ų | 135 | 150 Ų | 150 | 72% | 0.722 | 76% | 0.76 | S | S | * | * | trans | -150.7 | 169.6 | -164.6 | -144.9 | 11.7 | 0 | 0 | 0 | 111 | ||||
| 139 | N | 26.3 | Very low | 27.5 | Very low | 116 Ų | 116 | 149.1 Ų | 149.1 | 62% | 0.62 | 75% | 0.752 | S | S | * | * | trans | 71.6 | 152.3 | 166.2 | -63.9 | 26.4 | 0 | 0 | 0 | 116.1 | ||||
| 140 | E | 27.8 | Very low | 27.5 | Very low | 150 Ų | 150 | 147 Ų | 147 | 70% | 0.701 | 75% | 0.746 | S | S | * | * | cis | -162.5 | 158.4 | -4.5 | -122 | 176 | 90.2 | 0 | 0 | 111.7 | ||||
| 141 | S | 27.6 | Very low | 27.6 | Very low | 95 Ų | 95 | 144.2 Ų | 144.2 | 66% | 0.664 | 74% | 0.736 | S | S | * | * | trans | 60.5 | 147 | 138.8 | -59.1 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 142 | D | 27.8 | Very low | 27.5 | Very low | 146 Ų | 146 | 143.9 Ų | 143.9 | 78% | 0.781 | 73% | 0.728 | S | S | * | * | cis | -161.3 | -168.4 | -9.5 | -149.1 | -29.5 | 0 | 0 | 0 | 110 | ||||
| 143 | D | 27.4 | Very low | 27.5 | Very low | 115 Ų | 115 | 143.2 Ų | 143.2 | 62% | 0.615 | 73% | 0.725 | S | S | * | * | trans | 90.2 | 94.3 | 149.1 | -90.4 | -28.4 | 0 | 0 | 0 | 122.8 | ||||
| 144 | Q | 29.9 | Very low | 26.9 | Very low | 158 Ų | 158 | 146.6 Ų | 146.6 | 74% | 0.738 | 73% | 0.729 | S | S | * | * | 43.7 | 111.6 | 117.9 | -60.5 | -177.4 | 58.9 | 0 | 0 | 121.5 | |||||
| 145 | K | 28.9 | Very low | 26.9 | Very low | 181 Ų | 181 | 142.5 Ų | 142.5 | 79% | 0.787 | 73% | 0.731 | S | S | * | * | 168.6 | 127.5 | 109.4 | -95.7 | 167.2 | -176.5 | 164.6 | 0 | 115.4 | |||||
| 146 | N | 26.2 | Very low | 27 | Very low | 155 Ų | 155 | 140.5 Ų | 140.5 | 83% | 0.829 | 73% | 0.733 | S | S | * | * | 163 | 163.2 | 127.8 | -88.6 | -23.8 | 0 | 0 | 0 | 110.7 | |||||
| 147 | Q | 27.9 | Very low | 26.8 | Very low | 161 Ų | 161 | 143 Ų | 143 | 75% | 0.752 | 74% | 0.741 | S | S | * | * | cis | -166.3 | 138.4 | -43.8 | -177.3 | 62.9 | 6.9 | 0 | 0 | 106.9 | ||||
| 148 | K | 27.8 | Very low | 26.9 | Very low | 174 Ų | 174 | 138.2 Ų | 138.2 | 76% | 0.757 | 73% | 0.729 | S | S | * | * | trans | -60.1 | 161.1 | 172.4 | -141.4 | 176.7 | 179.5 | -176.8 | 0 | 110.2 | ||||
| 149 | V | 26.5 | Very low | 26.9 | Very low | 101 Ų | 101 | 139.1 Ų | 139.1 | 61% | 0.612 | 73% | 0.734 | S | S | * | * | cis | -165 | 172 | 39.1 | -165.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 150 | V | 26.5 | Very low | 27 | Very low | 129 Ų | 129 | 141.2 Ų | 141.2 | 78% | 0.782 | 75% | 0.745 | S | S | * | * | trans | 115.2 | 100.5 | 149.8 | -176.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 151 | E | 27.1 | Very low | 26.7 | Very low | 122 Ų | 122 | 137.1 Ų | 137.1 | 57% | 0.57 | 74% | 0.743 | S | S | * | * | cis | 66.3 | 129.3 | 42 | -63.3 | -170.8 | 148.2 | 0 | 0 | 114.1 | ||||
| 152 | Y | 28.4 | Very low | 27.5 | Very low | 185 Ų | 185 | 138.3 Ų | 138.3 | 73% | 0.725 | 75% | 0.748 | S | S | * | * | cis | -148.4 | -169.9 | -3.4 | -95.6 | -55.8 | 0 | 0 | 0 | 106.9 | ||||
| 153 | Q | 28.3 | Very low | 27.4 | Very low | 156 Ų | 156 | 139.4 Ų | 139.4 | 73% | 0.729 | 75% | 0.748 | S | S | * | * | cis | -160.3 | -177.1 | 12.6 | -139.7 | 179.7 | 98.8 | 0 | 0 | 106.2 | ||||
| 154 | K | 24.4 | Very low | 28.4 | Very low | 179 Ų | 179 | 138.3 Ų | 138.3 | 78% | 0.778 | 75% | 0.747 | S | S | * | * | cis | -160.5 | 130.7 | 5 | -176.3 | -175.6 | -173.9 | 179 | 0 | 111.3 | ||||
| 155 | G | 23.9 | Very low | 28.1 | Very low | 81 Ų | 81 | 138.9 Ų | 138.9 | 84% | 0.835 | 75% | 0.75 | S | S | * | * | trans | 74.1 | 152.8 | 159.5 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 156 | G | 25.4 | Very low | 27.9 | Very low | 69 Ų | 69 | 138.2 Ų | 138.2 | 71% | 0.711 | 75% | 0.75 | S | S | * | * | cis | 154.4 | 137.4 | -10.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 157 | E | 24.5 | Very low | 28.1 | Very low | 195 Ų | 195 | 138 Ų | 138 | 91% | 0.911 | 75% | 0.748 | S | S | * | * | trans | 63 | 161.6 | 169.5 | -62.7 | -179.2 | 108.2 | 0 | 0 | 116 | ||||
| 158 | S | 27.5 | Very low | 27.9 | Very low | 99 Ų | 99 | 135.6 Ų | 135.6 | 69% | 0.692 | 75% | 0.749 | S | S | * | * | cis | -158.1 | 141.9 | -28.6 | 48.9 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 159 | D | 25.8 | Very low | 28.7 | Very low | 155 Ų | 155 | 133.3 Ų | 133.3 | 83% | 0.829 | 75% | 0.752 | S | S | * | * | 66.5 | 164.7 | 99.8 | -151.1 | 4.5 | 0 | 0 | 0 | 116.5 | |||||
| 160 | L | 26.4 | Very low | 28.8 | Very low | 160 Ų | 160 | 132 Ų | 132 | 84% | 0.838 | 76% | 0.759 | S | S | * | * | trans | 93.9 | 124.4 | -179.1 | -56.3 | 176 | 0 | 0 | 0 | 118.9 | ||||
| 161 | G | 22 | Very low | 28.9 | Very low | 64 Ų | 64 | 134 Ų | 134 | 66% | 0.66 | 77% | 0.765 | S | S | * | * | trans | -111.6 | -150.8 | 136.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 162 | P | 45.6 | Very low | 28.9 | Very low | 119 Ų | 119 | 131.8 Ų | 131.8 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | cis | -140.4 | -172.2 | -6.4 | 45.4 | -28.5 | 0 | 0 | 0 | 114.6 | ||||
| 163 | Q | 25.6 | Very low | 29 | Very low | 170 Ų | 170 | 130.6 Ų | 130.6 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | trans | 67.7 | -169.8 | 158.7 | -64.5 | -77.1 | -27.8 | 0 | 0 | 116.1 | ||||
| 164 | P | 47.7 | Very low | 29.1 | Very low | 91 Ų | 91 | 126.5 Ų | 126.5 | 59% | 0.591 | 79% | 0.787 | S | S | * | * | -132.3 | -143 | -89.7 | 43.1 | -24.6 | 0 | 0 | 0 | 114.2 | |||||
| 165 | E | 24.6 | Very low | 29.2 | Very low | 171 Ų | 171 | 121.5 Ų | 121.5 | 80% | 0.799 | 79% | 0.786 | S | S | * | * | trans | 71.3 | 154.1 | 167.8 | -76.5 | 164.4 | -151.2 | 0 | 0 | 117.3 | ||||
| 166 | E | 24 | Very low | 30.3 | Very low | 166 Ų | 166 | 123.8 Ų | 123.8 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | cis | -163.2 | -161.7 | -31 | -151.5 | -162.5 | -169 | 0 | 0 | 108.4 | ||||
| 167 | L | 29.6 | Very low | 31.3 | Very low | 150 Ų | 150 | 126 Ų | 126 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | trans | 78.9 | 101.4 | 162.2 | -54 | -178.7 | 0 | 0 | 0 | 121.1 | ||||
| 168 | S | 25.1 | Very low | 31.6 | Very low | 112 Ų | 112 | 120.1 Ų | 120.1 | 78% | 0.783 | 78% | 0.78 | S | S | * | * | trans | -62.7 | -174 | 142.8 | -50.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 169 | P | 44.7 | Very low | 31.6 | Very low | 126 Ų | 126 | 125 Ų | 125 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | cis | -138.3 | -170.4 | 4.9 | 43.4 | -24.2 | 0 | 0 | 0 | 115.7 | ||||
| 170 | G | 27.2 | Very low | 31.5 | Very low | 73 Ų | 73 | 122.6 Ų | 122.6 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | trans | -179.4 | 108 | 167.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 171 | D | 28.4 | Very low | 31.5 | Very low | 171 Ų | 171 | 120.7 Ų | 120.7 | 91% | 0.914 | 78% | 0.784 | S | S | * | * | trans | -64.4 | 161.3 | -170.6 | -57.7 | -87 | 0 | 0 | 0 | 116.9 | ||||
| 172 | G | 28.8 | Very low | 31.8 | Very low | 76 Ų | 76 | 126.8 Ų | 126.8 | 78% | 0.784 | 80% | 0.796 | S | S | * | * | trans | 176.8 | 65.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 173 | V | 30.5 | Very low | 31.8 | Very low | 159 Ų | 159 | 126.3 Ų | 126.3 | 96% | 0.964 | 79% | 0.792 | S | S | * | * | trans | -35.4 | 141.5 | 166.8 | -177.3 | 0 | 0 | 0 | 0 | 114 | ||||
| 174 | G | 28.5 | Very low | 31.8 | Very low | 71 Ų | 71 | 123.1 Ų | 123.1 | 73% | 0.732 | 79% | 0.789 | S | S | * | * | cis | 170.3 | 175.7 | 1.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 175 | G | 26.7 | Very low | 30.8 | Very low | 74 Ų | 74 | 125.2 Ų | 125.2 | 76% | 0.763 | 80% | 0.8 | S | S | * | * | trans | -109.2 | -145.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 176 | P | 47.9 | Very low | 30.9 | Very low | 128 Ų | 128 | 122.3 Ų | 122.3 | 83% | 0.831 | 80% | 0.799 | S | S | * | * | cis | -128.5 | -114.5 | -29.8 | 34.7 | -14.7 | 0 | 0 | 0 | 109.9 | ||||
| 177 | P | 47.1 | Very low | 31.3 | Very low | 115 Ų | 115 | 121.4 Ų | 121.4 | 75% | 0.747 | 80% | 0.799 | S | S | * | * | -127 | 165.1 | -58.2 | 36.5 | -20.2 | 0 | 0 | 0 | 116.2 | |||||
| 178 | G | 29.3 | Very low | 31.2 | Very low | 73 Ų | 73 | 117.9 Ų | 117.9 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | trans | 80.8 | 174.8 | 144.4 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 179 | K | 27.5 | Very low | 31.5 | Very low | 200 Ų | 200 | 120 Ų | 120 | 87% | 0.87 | 80% | 0.796 | S | S | * | * | cis | -160.4 | 138.8 | -4.8 | -122.6 | 176.9 | -175.7 | 179.8 | 0 | 111.8 | ||||
| 180 | S | 25.1 | Very low | 31 | Very low | 106 Ų | 106 | 120.7 Ų | 120.7 | 74% | 0.741 | 79% | 0.792 | S | S | * | * | trans | 18.6 | 132.2 | 150.1 | 59.2 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 181 | S | 26.3 | Very low | 31.1 | Very low | 120 Ų | 120 | 125.4 Ų | 125.4 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | -170 | 119.9 | 123.8 | 52.5 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 182 | E | 27.6 | Very low | 31.2 | Very low | 192 Ų | 192 | 124.7 Ų | 124.7 | 90% | 0.897 | 79% | 0.785 | S | S | * | * | trans | -119.8 | -176.9 | 150.9 | -78.4 | -159.3 | 153.4 | 0 | 0 | 106.6 | ||||
| 183 | P | 45.7 | Very low | 31.5 | Very low | 109 Ų | 109 | 130.8 Ų | 130.8 | 71% | 0.708 | 79% | 0.786 | S | S | * | * | cis | -133.4 | -171 | -0.2 | 42.5 | -25.5 | 0 | 0 | 0 | 114.2 | ||||
| 184 | S | 25.2 | Very low | 31.7 | Very low | 103 Ų | 103 | 130 Ų | 130 | 72% | 0.72 | 78% | 0.776 | S | S | * | * | 162.7 | 123.5 | 117.7 | 52.5 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 185 | T | 26.4 | Very low | 32.2 | Very low | 134 Ų | 134 | 134.5 Ų | 134.5 | 82% | 0.822 | 78% | 0.783 | S | S | * | * | trans | 39.7 | 149.3 | 134 | 55.1 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 186 | S | 28.1 | Very low | 33 | Very low | 111 Ų | 111 | 138.8 Ų | 138.8 | 78% | 0.776 | 79% | 0.788 | S | S | * | * | cis | -164.5 | -176.6 | 5.8 | 37.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 187 | L | 31.9 | Very low | 32.4 | Very low | 147 Ų | 147 | 139.6 Ų | 139.6 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | trans | -61.4 | 171.1 | -178.4 | -79.9 | 70.1 | 0 | 0 | 0 | 116.4 | E189 | L187-E189 VanDerWaalsContact CB-OE1 3.28Å; L187-E189 WeakPolarHBondContact CB-OE1 3.48Å; L187-E189 WeakPolarHBondContact CD2-OE1 3.28Å | ||
| 188 | G | 27.7 | Very low | 32.2 | Very low | 76 Ų | 76 | 142.4 Ų | 142.4 | 78% | 0.784 | 79% | 0.791 | S | S | * | * | trans | -139.6 | 145.5 | 159 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 189 | E | 31.5 | Very low | 32.9 | Very low | 156 Ų | 156 | 146.4 Ų | 146.4 | 73% | 0.729 | 79% | 0.79 | S | S | * | * | trans | -151.9 | 157.4 | -160.1 | -80 | 150.9 | -97.4 | 0 | 0 | 109.2 | L187 | L187-E189 VanDerWaalsContact CB-OE1 3.28Å; L187-E189 WeakPolarHBondContact CB-OE1 3.48Å; L187-E189 WeakPolarHBondContact CD2-OE1 3.28Å | ||
| 190 | L | 33.4 | Very low | 33.8 | Very low | 140 Ų | 140 | 143.4 Ų | 143.4 | 73% | 0.733 | 78% | 0.782 | S | S | * | * | cis | -166.4 | 152.3 | -8.4 | 165.9 | 65.7 | 0 | 0 | 0 | 107.6 | ||||
| 191 | E | 29.1 | Very low | 34.8 | Very low | 172 Ų | 172 | 146.6 Ų | 146.6 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | trans | -128.1 | 146.9 | 172.9 | -70.4 | -168.7 | 172.9 | 0 | 0 | 113.5 | ||||
| 192 | H | 31.4 | Very low | 35.4 | Very low | 156 Ų | 156 | 147.6 Ų | 147.6 | 72% | 0.722 | 79% | 0.786 | S | S | * | * | trans | -126.9 | 149.8 | -178.2 | -112.6 | -96 | 0 | 0 | 0 | 109.9 | ||||
| 193 | Y | 34.8 | Very low | 36 | Very low | 205 Ų | 205 | 144.5 Ų | 144.5 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | -137.5 | 127.7 | 165 | -93.2 | -87.9 | 0 | 0 | 0 | 110 | ||||
| 194 | D | 35.8 | Very low | 35.7 | Very low | 142 Ų | 142 | 144.3 Ų | 144.3 | 76% | 0.759 | 78% | 0.779 | S | S | * | * | trans | -90.7 | 141.1 | 172.2 | -56.5 | -50.8 | 0 | 0 | 0 | 110.3 | ||||
| 195 | L | 38.7 | Very low | 36 | Very low | 166 Ų | 166 | 149.6 Ų | 149.6 | 87% | 0.869 | 79% | 0.785 | S | S | * | * | trans | -146 | 96.5 | 172.2 | -74.7 | 178.9 | 0 | 0 | 0 | 110.7 | ||||
| 196 | D | 42.8 | Very low | 36.5 | Very low | 164 Ų | 164 | 150.3 Ų | 150.3 | 88% | 0.877 | 78% | 0.782 | S | S | * | * | trans | -78 | 131 | 163.5 | -71.5 | -42 | 0 | 0 | 0 | 110.1 | ||||
| 197 | M | 35.7 | Very low | 36.6 | Very low | 145 Ų | 145 | 153.8 Ų | 153.8 | 71% | 0.714 | 78% | 0.783 | S | S | * | * | trans | -151.3 | 80.4 | 165.8 | -91.7 | -139.5 | 68.8 | 0 | 0 | 111.8 | E199 | M197-E199 VanDerWaalsContact C-N 3.27Å; M197-E199 HydrophobicContact CE-CB 3.83Å; M197-E199 PolarHBondContact O-N 2.97Å; M197-E199 VanDerWaalsContact O-N 3.11Å | ||
| 198 | D | 43.4 | Very low | 36.4 | Very low | 174 Ų | 174 | 152 Ų | 152 | 93% | 0.93 | 78% | 0.783 | S | S | * | * | trans | -74.7 | 75.8 | 158.1 | -89.7 | -40 | 0 | 0 | 0 | 109.9 | ||||
| 199 | E | 43.2 | Very low | 36.4 | Very low | 156 Ų | 156 | 154 Ų | 154 | 73% | 0.729 | 79% | 0.785 | S | S | * | * | trans | -156.2 | 152.9 | 166.9 | -131 | 168.4 | -144.5 | 0 | 0 | 115 | M197 | M197-E199 VanDerWaalsContact C-N 3.27Å; M197-E199 HydrophobicContact CE-CB 3.83Å; M197-E199 PolarHBondContact O-N 2.97Å; M197-E199 VanDerWaalsContact O-N 3.11Å | ||
| 200 | I | 45.9 | Very low | 36.5 | Very low | 137 Ų | 137 | 154.4 Ų | 154.4 | 70% | 0.703 | 79% | 0.787 | S | S | * | * | trans | 70.1 | 68.1 | 173.4 | -41.6 | 176.7 | 0 | 0 | 0 | 115.8 | D202 | I200-D202 HydrophobicContact CG2-CB 4.04Š| ||
| 201 | L | 45.5 | Very low | 36.4 | Very low | 174 Ų | 174 | 157 Ų | 157 | 91% | 0.911 | 80% | 0.795 | S | S | * | * | trans | -75.5 | 108.8 | 140.2 | -81 | 170.1 | 0 | 0 | 0 | 108.7 | ||||
| 202 | D | 39.5 | Very low | 36.5 | Very low | 141 Ų | 141 | 156.4 Ų | 156.4 | 75% | 0.754 | 80% | 0.797 | S | S | * | * | trans | -146.6 | 91.7 | 170.3 | -130.3 | -22.3 | 0 | 0 | 0 | 111.6 | I200 | I200-D202 HydrophobicContact CG2-CB 4.04Š| ||
| 203 | V | 40.5 | Very low | 36.3 | Very low | 127 Ų | 127 | 154 Ų | 154 | 77% | 0.77 | 80% | 0.804 | S | S | * | * | trans | -95.5 | 117.6 | 177.4 | 178.6 | 0 | 0 | 0 | 0 | 109 | Y205 | V203-Y205 PolarHBondContact O-N 3.45Å; V203-Y205 VanDerWaalsContact O-N 3.07Å | ||
| 204 | P | 39.6 | Very low | 35.8 | Very low | 105 Ų | 105 | 149.1 Ų | 149.1 | 68% | 0.682 | 80% | 0.8 | S | S | * | * | trans | -68.1 | 110.4 | -175.2 | 25.6 | -33.6 | 0 | 0 | 0 | 112 | I206 | P204-I206 PolarHBondContact O-N 3.05Š| ||
| 205 | Y | 31 | Very low | 35.4 | Very low | 213 Ų | 213 | 151.5 Ų | 151.5 | 84% | 0.835 | 80% | 0.804 | S | S | * | * | trans | -71.9 | 87.1 | 179.5 | -172.8 | -94 | 0 | 0 | 0 | 111.8 | V203 K207 | V203-Y205 PolarHBondContact O-N 3.45Å; V203-Y205 VanDerWaalsContact O-N 3.07Å; Y205-K207 PolarHBondContact O-N 3.43Å | ||
| 206 | I | 37.8 | Very low | 34.8 | Very low | 150 Ų | 150 | 150.4 Ų | 150.4 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | -76.2 | 114.6 | 179.4 | -62.3 | 178 | 0 | 0 | 0 | 110.6 | P204 S208 | P204-I206 PolarHBondContact O-N 3.05Å; I206-S208 PolarHBondContact O-N 3.42Å | ||
| 207 | K | 28.8 | Very low | 34 | Very low | 183 Ų | 183 | 151.9 Ų | 151.9 | 80% | 0.796 | 80% | 0.803 | S | S | * | * | trans | -91.4 | 94.9 | -177.4 | -164.7 | 174.5 | -172.3 | 174.4 | 0 | 111.1 | Y205 S209 | Y205-K207 PolarHBondContact O-N 3.43Å; K207-S209 PolarHBondContact O-N 3.18Å | ||
| 208 | S | 27.9 | Very low | 33.4 | Very low | 111 Ų | 111 | 151 Ų | 151 | 78% | 0.776 | 81% | 0.805 | S | S | * | * | trans | -75.1 | 101 | -176.7 | 45.9 | 0 | 0 | 0 | 0 | 113.1 | I206 | I206-S208 PolarHBondContact O-N 3.42Š| ||
| 209 | S | 29 | Very low | 32.4 | Very low | 118 Ų | 118 | 149.1 Ų | 149.1 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | trans | -87.8 | 123.5 | 164.6 | -167.5 | 0 | 0 | 0 | 0 | 109.8 | K207 | K207-S209 PolarHBondContact O-N 3.18Š| ||
| 210 | Q | 32.2 | Very low | 31.8 | Very low | 164 Ų | 164 | 147.1 Ų | 147.1 | 77% | 0.766 | 80% | 0.803 | S | S | * | * | trans | -84.6 | 137 | 172.8 | -58.8 | 176.8 | 11.1 | 0 | 0 | 110.5 | ||||
| 211 | Q | 32.6 | Very low | 30.8 | Very low | 193 Ų | 193 | 149.1 Ų | 149.1 | 90% | 0.902 | 81% | 0.81 | S | S | * | * | trans | -144.7 | 136.7 | 137.2 | -76.1 | -157.5 | -40.6 | 0 | 0 | 108.5 | ||||
| 212 | L | 30.1 | Very low | 30 | Very low | 161 Ų | 161 | 149.1 Ų | 149.1 | 84% | 0.843 | 80% | 0.802 | S | S | * | * | trans | -95.8 | 147.6 | 172 | -86 | 77.1 | 0 | 0 | 0 | 109.9 | ||||
| 213 | A | 27.1 | Very low | 29.6 | Very low | 104 Ų | 104 | 152.1 Ų | 152.1 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -146.4 | 127.6 | 156.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 214 | S | 25.9 | Very low | 29.1 | Very low | 103 Ų | 103 | 153.2 Ų | 153.2 | 72% | 0.72 | 80% | 0.803 | S | S | * | * | trans | -82.2 | 165.6 | 170.1 | -6.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 215 | F | 25.8 | Very low | 28.5 | Very low | 192 Ų | 192 | 156.1 Ų | 156.1 | 84% | 0.842 | 81% | 0.812 | S | S | * | * | cis | -159.3 | -170.1 | 4.9 | -126.2 | -46 | 0 | 0 | 0 | 109.1 | ||||
| 216 | T | 25.7 | Very low | 28.3 | Very low | 143 Ų | 143 | 149.1 Ų | 149.1 | 88% | 0.877 | 80% | 0.804 | S | S | * | * | trans | 91.4 | 170.6 | 164.2 | 80.2 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 217 | K | 26.3 | Very low | 27.8 | Very low | 195 Ų | 195 | 149.4 Ų | 149.4 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | -141.4 | 129.8 | -148.5 | 158.6 | -165.9 | 177.9 | -179.9 | 0 | 108.9 | ||||
| 218 | V | 23 | Very low | 27.8 | Very low | 127 Ų | 127 | 146 Ų | 146 | 77% | 0.77 | 81% | 0.805 | S | S | * | * | trans | 176.3 | 134.4 | 145.9 | 138.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 219 | T | 23.6 | Very low | 27.7 | Very low | 135 Ų | 135 | 146.7 Ų | 146.7 | 83% | 0.828 | 80% | 0.804 | S | S | * | * | trans | 49.3 | 150.5 | 161.7 | 54.9 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 220 | S | 30.1 | Very low | 27.7 | Very low | 113 Ų | 113 | 147 Ų | 147 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -91.4 | 151.3 | 175.3 | 49.2 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 221 | E | 24 | Very low | 27.7 | Very low | 180 Ų | 180 | 145.9 Ų | 145.9 | 84% | 0.841 | 80% | 0.799 | S | S | * | * | trans | -147.4 | -176.5 | 153 | -127.5 | -164.8 | 153.8 | 0 | 0 | 113.6 | ||||
| 222 | K | 29.9 | Very low | 27.5 | Very low | 174 Ų | 174 | 143.8 Ų | 143.8 | 76% | 0.757 | 79% | 0.794 | S | S | * | * | trans | -126.9 | 154.4 | -151.9 | -61 | 174.1 | 179.5 | 172.6 | 0 | 116.4 | ||||
| 223 | R | 29.9 | Very low | 27.4 | Very low | 204 Ų | 204 | 139.2 Ų | 139.2 | 77% | 0.77 | 79% | 0.786 | S | S | * | * | trans | 106.6 | 129.3 | 165.5 | -66.4 | 164.4 | -79.8 | -167 | -7.5 | 113.5 | ||||
| 224 | I | 30 | Very low | 27.6 | Very low | 150 Ų | 150 | 143 Ų | 143 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | cis | 88.6 | 140.5 | 21.5 | -50.3 | 164.3 | 0 | 0 | 0 | 114.7 | ||||
| 225 | L | 28.1 | Very low | 27.6 | Very low | 166 Ų | 166 | 144 Ų | 144 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | trans | 87.4 | 141.4 | 179.2 | -67.3 | 115.9 | 0 | 0 | 0 | 115.9 | ||||
| 226 | G | 27.1 | Very low | 27.7 | Very low | 65 Ų | 65 | 137.9 Ų | 137.9 | 67% | 0.67 | 79% | 0.789 | S | S | * | * | cis | -158.3 | -176.2 | -3.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 227 | L | 26.9 | Very low | 27.9 | Very low | 157 Ų | 157 | 141.2 Ų | 141.2 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | cis | -138.9 | 153.5 | 25.4 | -103.4 | 58.3 | 0 | 0 | 0 | 109.2 | ||||
| 228 | C | 28 | Very low | 27.8 | Very low | 111 Ų | 111 | 136.1 Ų | 136.1 | 75% | 0.75 | 79% | 0.785 | S | S | * | * | 50.5 | 125.4 | 83.6 | -53.5 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 229 | T | 26.8 | Very low | 27.8 | Very low | 125 Ų | 125 | 135.6 Ų | 135.6 | 77% | 0.767 | 79% | 0.786 | S | S | * | * | cis | -143.7 | -141.5 | 1.4 | -19.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 230 | T | 29.7 | Very low | 27.7 | Very low | 126 Ų | 126 | 133.9 Ų | 133.9 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | cis | -157.6 | 162.5 | 15.1 | -33.7 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 231 | I | 30.9 | Very low | 27.4 | Very low | 139 Ų | 139 | 135.5 Ų | 135.5 | 71% | 0.713 | 79% | 0.785 | S | S | * | * | trans | -84.8 | 168.2 | 170.9 | 31.8 | 172.4 | 0 | 0 | 0 | 111.6 | ||||
| 232 | N | 29.8 | Very low | 27.4 | Very low | 149 Ų | 149 | 130.2 Ų | 130.2 | 80% | 0.797 | 78% | 0.779 | S | S | * | * | cis | -155.5 | 174.6 | 27.5 | -116 | -27 | 0 | 0 | 0 | 110.3 | ||||
| 233 | G | 27.7 | Very low | 27.1 | Very low | 65 Ų | 65 | 127.6 Ų | 127.6 | 67% | 0.67 | 78% | 0.782 | S | S | * | * | cis | -179.8 | -169.4 | 5.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 234 | L | 31.1 | Very low | 26.9 | Very low | 185 Ų | 185 | 122.9 Ų | 122.9 | 97% | 0.969 | 78% | 0.781 | S | S | * | * | trans | -120.9 | 148.5 | -167.9 | -76.4 | 159.8 | 0 | 0 | 0 | 114.4 | ||||
| 235 | S | 26.1 | Very low | 26.6 | Very low | 124 Ų | 124 | 124.5 Ų | 124.5 | 87% | 0.867 | 79% | 0.785 | S | S | * | * | trans | -167.3 | 150.3 | 155.4 | -164.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 236 | G | 27.8 | Very low | 26.4 | Very low | 63 Ų | 63 | 122.1 Ų | 122.1 | 65% | 0.649 | 78% | 0.782 | S | S | * | * | cis | 156.6 | 95.3 | -10 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 237 | K | 29.3 | Very low | 26.4 | Very low | 213 Ų | 213 | 123.8 Ų | 123.8 | 93% | 0.926 | 78% | 0.784 | S | S | * | * | trans | 70.8 | 117.1 | 158.2 | -68.7 | -177.3 | 174.8 | -179.7 | 0 | 122 | ||||
| 238 | A | 24.1 | Very low | 26.3 | Very low | 88 Ų | 88 | 121.9 Ų | 121.9 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | 85.2 | 123.3 | 114.3 | 0 | 0 | 0 | 0 | 0 | 124.1 | |||||
| 239 | C | 23.2 | Very low | 26.3 | Very low | 116 Ų | 116 | 120.6 Ų | 120.6 | 78% | 0.784 | 78% | 0.775 | S | S | * | * | trans | 80.7 | 106.8 | 134.1 | -67.5 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 240 | S | 22.3 | Very low | 26.3 | Very low | 98 Ų | 98 | 121.3 Ų | 121.3 | 69% | 0.685 | 77% | 0.774 | S | S | * | * | 91.7 | 122.6 | 120.1 | -58.9 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 241 | T | 22.7 | Very low | 26.1 | Very low | 148 Ų | 148 | 123.3 Ų | 123.3 | 91% | 0.908 | 78% | 0.777 | S | S | * | * | trans | 72.3 | 132.2 | 138.6 | 51.8 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 242 | G | 23.3 | Very low | 25.8 | Very low | 69 Ų | 69 | 120.2 Ų | 120.2 | 71% | 0.711 | 77% | 0.772 | S | S | * | * | trans | 115.3 | 116.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 243 | S | 23.8 | Very low | 26.5 | Very low | 119 Ų | 119 | 118.5 Ų | 118.5 | 83% | 0.832 | 77% | 0.77 | S | S | * | * | cis | 100.9 | 146.6 | 41.2 | -72.6 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 244 | S | 25.5 | Very low | 26.6 | Very low | 105 Ų | 105 | 124.5 Ų | 124.5 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | trans | 60.1 | 96.3 | 170.7 | 57.4 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 245 | E | 24.1 | Very low | 26.4 | Very low | 184 Ų | 184 | 121.3 Ų | 121.3 | 86% | 0.86 | 77% | 0.769 | S | S | * | * | 46.3 | 146.9 | 114.1 | -61.3 | -178.1 | 126.8 | 0 | 0 | 124.1 | |||||
| 246 | S | 24.4 | Very low | 26.5 | Very low | 115 Ų | 115 | 121.2 Ų | 121.2 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | trans | 79.1 | 154.2 | 152.1 | 78.8 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 247 | S | 26.7 | Very low | 26.5 | Very low | 101 Ų | 101 | 125.9 Ų | 125.9 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | cis | -170.9 | 163.2 | -34.1 | 61.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 248 | S | 24.5 | Very low | 26.5 | Very low | 116 Ų | 116 | 120.9 Ų | 120.9 | 81% | 0.811 | 77% | 0.765 | S | S | * | * | trans | 70.4 | 164.4 | 159.5 | 87.1 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 249 | S | 27.9 | Very low | 27.9 | Very low | 84 Ų | 84 | 122.3 Ų | 122.3 | 59% | 0.587 | 77% | 0.766 | S | S | * | * | cis | -159.4 | 153.1 | 2 | 80.3 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 250 | N | 26.7 | Very low | 28 | Very low | 140 Ų | 140 | 122.1 Ų | 122.1 | 75% | 0.749 | 76% | 0.761 | S | S | * | * | trans | 64.4 | 155.7 | 141.9 | -62.7 | -21.5 | 0 | 0 | 0 | 121.5 | ||||
| 251 | M | 27.5 | Very low | 28.2 | Very low | 168 Ų | 168 | 127 Ų | 127 | 83% | 0.828 | 77% | 0.77 | S | S | * | * | cis | -162.7 | 173 | -25.7 | -114.2 | -62.3 | 147.4 | 0 | 0 | 111.1 | ||||
| 252 | A | 24.1 | Very low | 28.9 | Very low | 74 Ų | 74 | 124.8 Ų | 124.8 | 61% | 0.612 | 76% | 0.761 | S | S | * | * | trans | -70.6 | 174.9 | -176.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 253 | P | 43.2 | Very low | 30.1 | Very low | 114 Ų | 114 | 127 Ų | 127 | 74% | 0.74 | 76% | 0.763 | S | S | * | * | -157 | 137.3 | 77.3 | 38.3 | -15.7 | 0 | 0 | 0 | 121 | |||||
| 254 | F | 30 | Very low | 30.6 | Very low | 190 Ų | 190 | 129.7 Ų | 129.7 | 83% | 0.833 | 76% | 0.762 | S | S | * | * | trans | 63.5 | 161.1 | 131.5 | -77.1 | -78.8 | 0 | 0 | 0 | 127.3 | ||||
| 255 | C | 26.8 | Very low | 31.1 | Very low | 119 Ų | 119 | 131.5 Ų | 131.5 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | trans | 86.8 | 118.2 | 168.3 | -62.7 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 256 | V | 28 | Very low | 31.8 | Very low | 121 Ų | 121 | 132.7 Ų | 132.7 | 73% | 0.733 | 76% | 0.759 | S | S | * | * | cis | 109.3 | 134.8 | 12.4 | -178.5 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 257 | L | 28 | Very low | 31.9 | Very low | 161 Ų | 161 | 137.4 Ų | 137.4 | 84% | 0.843 | 77% | 0.765 | S | S | * | * | trans | 100.7 | 135.1 | 174.3 | -57.1 | -173.1 | 0 | 0 | 0 | 119.6 | ||||
| 258 | S | 30.5 | Very low | 32 | Very low | 109 Ų | 109 | 137.4 Ų | 137.4 | 76% | 0.762 | 77% | 0.771 | S | S | * | * | trans | -116.7 | -165.5 | 157.8 | -40 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 259 | P | 52 | Low | 32.1 | Very low | 118 Ų | 118 | 137.5 Ų | 137.5 | 77% | 0.766 | 77% | 0.772 | S | S | * | * | cis | -136.9 | -155.3 | -6 | 30.4 | -4.7 | 0 | 0 | 0 | 113.6 | ||||
| 260 | V | 26 | Very low | 32.1 | Very low | 112 Ų | 112 | 137.8 Ų | 137.8 | 68% | 0.679 | 78% | 0.779 | S | S | * | * | trans | 122.3 | 102.6 | 144.8 | 177.6 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 261 | K | 27.1 | Very low | 32.1 | Very low | 200 Ų | 200 | 137.7 Ų | 137.7 | 87% | 0.87 | 78% | 0.783 | S | S | * | * | 60.8 | 163.8 | 129.9 | -57.6 | 179.7 | -167.8 | 172.7 | 0 | 124.3 | |||||
| 262 | S | 37.8 | Very low | 32 | Very low | 102 Ų | 102 | 137 Ų | 137 | 71% | 0.713 | 78% | 0.782 | S | S | * | * | trans | -123.7 | 171.8 | 178.4 | 56.2 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 263 | P | 47.2 | Very low | 32.1 | Very low | 116 Ų | 116 | 143.4 Ų | 143.4 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | -120.7 | 142.7 | 158.1 | 35.5 | -23.3 | 0 | 0 | 0 | 112.3 | ||||
| 264 | H | 35.5 | Very low | 31.2 | Very low | 175 Ų | 175 | 142.3 Ų | 142.3 | 81% | 0.81 | 78% | 0.778 | S | S | * | * | 78.2 | 134.2 | 51.1 | -71.6 | -45.1 | 0 | 0 | 0 | 114.7 | |||||
| 265 | L | 35.5 | Very low | 31.1 | Very low | 143 Ų | 143 | 140 Ų | 140 | 75% | 0.749 | 77% | 0.77 | S | S | * | * | -171 | 174.4 | 68 | -76.7 | 171 | 0 | 0 | 0 | 110.7 | |||||
| 266 | R | 37.8 | Very low | 31.1 | Very low | 208 Ų | 208 | 142 Ų | 142 | 79% | 0.785 | 77% | 0.767 | S | S | * | * | cis | 175.7 | 95.3 | -26.9 | 178.4 | -125.6 | -60.6 | 172.5 | 4.7 | 112.5 | ||||
| 267 | K | 26.9 | Very low | 31.1 | Very low | 215 Ų | 215 | 144.8 Ų | 144.8 | 94% | 0.935 | 77% | 0.769 | S | S | * | * | trans | -155.5 | 143.2 | 166.5 | -87.9 | -172.6 | 176.2 | 178.3 | 0 | 110.6 | ||||
| 268 | A | 28.9 | Very low | 31 | Very low | 100 Ų | 100 | 144.4 Ų | 144.4 | 83% | 0.826 | 77% | 0.767 | S | S | * | * | cis | -156.8 | 173.6 | -15.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 269 | S | 26.6 | Very low | 30.9 | Very low | 119 Ų | 119 | 143.6 Ų | 143.6 | 83% | 0.832 | 77% | 0.767 | S | S | * | * | trans | -92.9 | 176.8 | -169.3 | 57 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 270 | A | 27.8 | Very low | 29.7 | Very low | 90 Ų | 90 | 143.8 Ų | 143.8 | 74% | 0.744 | 77% | 0.766 | S | S | * | * | cis | -133 | -131 | 6.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 271 | V | 27.2 | Very low | 29.7 | Very low | 137 Ų | 137 | 147.1 Ų | 147.1 | 83% | 0.83 | 77% | 0.774 | S | S | * | * | cis | -149.1 | 165.1 | 15.1 | -173.7 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 272 | I | 26 | Very low | 29.8 | Very low | 155 Ų | 155 | 144 Ų | 144 | 80% | 0.795 | 76% | 0.763 | S | S | * | * | trans | -54.5 | 163.8 | 165.7 | -67.3 | 162.7 | 0 | 0 | 0 | 113.6 | ||||
| 273 | R | 25.6 | Very low | 29.3 | Very low | 207 Ų | 207 | 144.2 Ų | 144.2 | 78% | 0.781 | 76% | 0.76 | S | S | * | * | cis | 169.9 | 143.5 | -23.9 | -174.1 | -167.4 | 165.2 | 157.6 | 3.5 | 108.4 | ||||
| 274 | D | 24.7 | Very low | 28.4 | Very low | 91 Ų | 91 | 145.3 Ų | 145.3 | 49% | 0.487 | 76% | 0.755 | S | S | . | * | trans | 47.4 | 121.5 | 157.7 | -69.9 | -26.6 | 0 | 0 | 0 | 121.6 | ||||
| 275 | Q | 27.6 | Very low | 28 | Very low | 142 Ų | 142 | 143.6 Ų | 143.6 | 66% | 0.664 | 75% | 0.75 | S | S | * | * | 70.2 | 157.4 | 94.7 | -62 | -176.7 | 71.8 | 0 | 0 | 116.6 | |||||
| 276 | H | 27.1 | Very low | 27.7 | Very low | 161 Ų | 161 | 140.8 Ų | 140.8 | 75% | 0.745 | 74% | 0.742 | S | S | * | * | cis | -118.5 | -135.2 | 0.9 | -54.5 | -94 | 0 | 0 | 0 | 109.5 | ||||
| 277 | K | 27.9 | Very low | 27.8 | Very low | 179 Ų | 179 | 136.4 Ų | 136.4 | 78% | 0.778 | 74% | 0.741 | S | S | * | * | cis | -162.9 | 168.3 | -1 | -148.5 | -167.4 | 173.5 | -173.8 | 0 | 111.2 | ||||
| 278 | L | 26.3 | Very low | 28.5 | Very low | 153 Ų | 153 | 131.2 Ų | 131.2 | 80% | 0.801 | 73% | 0.729 | S | S | * | * | trans | 77.8 | 136.9 | 166 | -58 | 172.8 | 0 | 0 | 0 | 116.3 | ||||
| 279 | A | 27 | Very low | 28.4 | Very low | 92 Ų | 92 | 134.2 Ų | 134.2 | 76% | 0.76 | 73% | 0.73 | S | S | * | * | cis | -138.5 | 172.2 | -1.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 280 | T | 27.6 | Very low | 28.4 | Very low | 122 Ų | 122 | 134.3 Ų | 134.3 | 75% | 0.748 | 73% | 0.726 | S | S | * | * | trans | -141.8 | 133.1 | -173.4 | -54.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 281 | E | 26.2 | Very low | 28.3 | Very low | 183 Ų | 183 | 139.1 Ų | 139.1 | 86% | 0.855 | 73% | 0.73 | S | S | * | * | trans | -156.8 | 141.7 | 145.7 | -73.1 | -161.4 | 167.3 | 0 | 0 | 105.7 | ||||
| 282 | E | 28 | Very low | 28.1 | Very low | 135 Ų | 135 | 139 Ų | 139 | 63% | 0.631 | 73% | 0.733 | S | S | * | * | cis | -167.6 | 162.4 | -13.7 | -103.8 | -35.6 | 76.4 | 0 | 0 | 106.2 | ||||
| 283 | T | 28.7 | Very low | 27.9 | Very low | 105 Ų | 105 | 134.8 Ų | 134.8 | 64% | 0.644 | 73% | 0.728 | S | S | * | * | cis | -170.4 | 171.1 | -8.1 | -154.3 | 0 | 0 | 0 | 0 | 106 | ||||
| 284 | E | 28.3 | Very low | 27.9 | Very low | 140 Ų | 140 | 130.6 Ų | 130.6 | 65% | 0.654 | 73% | 0.731 | S | S | * | * | cis | -160.5 | -166.5 | -5.2 | -145.6 | -71.3 | 88.1 | 0 | 0 | 106.2 | ||||
| 285 | I | 26.7 | Very low | 27.8 | Very low | 139 Ų | 139 | 130.3 Ų | 130.3 | 71% | 0.713 | 74% | 0.741 | S | S | * | * | trans | 78.9 | 69.8 | 162.2 | -55.8 | 159.5 | 0 | 0 | 0 | 114.7 | ||||
| 286 | S | 28.1 | Very low | 27.7 | Very low | 83 Ų | 83 | 134 Ų | 134 | 58% | 0.58 | 75% | 0.751 | S | S | * | * | 31.5 | 158.2 | 103.3 | 85.9 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 287 | P | 41.5 | Very low | 27.5 | Very low | 116 Ų | 116 | 133.7 Ų | 133.7 | 75% | 0.753 | 75% | 0.749 | S | S | * | * | cis | -132.8 | -131.1 | -33 | 35.2 | -11.6 | 0 | 0 | 0 | 112.4 | ||||
| 288 | P | 40.1 | Very low | 28.1 | Very low | 107 Ų | 107 | 130 Ų | 130 | 70% | 0.695 | 74% | 0.744 | S | S | * | * | -141 | 179.9 | -122.8 | 45.1 | -23.2 | 0 | 0 | 0 | 119.4 | |||||
| 289 | L | 26.8 | Very low | 28 | Very low | 162 Ų | 162 | 130.2 Ų | 130.2 | 85% | 0.848 | 74% | 0.741 | S | S | * | * | trans | 77.8 | 159.8 | 141.6 | -150.9 | 72.5 | 0 | 0 | 0 | 120.6 | ||||
| 290 | V | 27.4 | Very low | 28.1 | Very low | 122 Ų | 122 | 132 Ų | 132 | 74% | 0.739 | 74% | 0.738 | S | S | * | * | trans | 99.8 | 111.6 | 155.7 | -166.9 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 291 | K | 25.6 | Very low | 28 | Very low | 191 Ų | 191 | 134.6 Ų | 134.6 | 83% | 0.83 | 74% | 0.741 | S | S | * | * | trans | -15.5 | 139 | 150.6 | -64.9 | 173.3 | 175.2 | 176.3 | 0 | 120.3 | ||||
| 292 | C | 22.2 | Very low | 28.1 | Very low | 133 Ų | 133 | 129.9 Ų | 129.9 | 90% | 0.899 | 73% | 0.729 | S | S | * | * | 56.1 | 124.3 | 119.9 | -161.6 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 293 | G | 23.3 | Very low | 28.1 | Very low | 67 Ų | 67 | 132.1 Ų | 132.1 | 69% | 0.691 | 74% | 0.736 | S | S | * | * | 129.6 | 119.5 | 121.8 | 0 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 294 | S | 24.1 | Very low | 28 | Very low | 119 Ų | 119 | 132.6 Ų | 132.6 | 83% | 0.832 | 74% | 0.735 | S | S | * | * | trans | 64.3 | 90.7 | 139.3 | -170.8 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 295 | A | 24.1 | Very low | 27.9 | Very low | 85 Ų | 85 | 133.9 Ų | 133.9 | 70% | 0.702 | 74% | 0.739 | S | S | * | * | 68 | 159.3 | 119 | 0 | 0 | 0 | 0 | 0 | 123.4 | |||||
| 296 | Y | 24.1 | Very low | 28 | Very low | 220 Ų | 220 | 133.9 Ų | 133.9 | 86% | 0.863 | 74% | 0.739 | S | S | * | * | trans | 75.7 | 107.3 | 171.5 | -83.7 | -91.2 | 0 | 0 | 0 | 119.8 | ||||
| 297 | E | 24.1 | Very low | 27.9 | Very low | 154 Ų | 154 | 135.5 Ų | 135.5 | 72% | 0.72 | 74% | 0.741 | S | S | * | * | 19.4 | 147 | 109.9 | -75.3 | -62.3 | 117.7 | 0 | 0 | 118.5 | |||||
| 298 | P | 39 | Very low | 27.1 | Very low | 103 Ų | 103 | 138.3 Ų | 138.3 | 67% | 0.669 | 74% | 0.742 | S | S | * | * | -155 | 167.7 | 50.6 | 44.2 | -24.1 | 0 | 0 | 0 | 120.8 | |||||
| 299 | E | 26 | Very low | 26.3 | Very low | 156 Ų | 156 | 139.4 Ų | 139.4 | 73% | 0.729 | 75% | 0.747 | S | S | * | * | trans | 65.6 | 155.1 | 136.6 | -83.2 | -161.6 | 108.1 | 0 | 0 | 122.2 | ||||
| 300 | N | 28.3 | Very low | 26.2 | Very low | 131 Ų | 131 | 141 Ų | 141 | 70% | 0.701 | 75% | 0.747 | S | S | * | * | cis | -168.4 | -171.2 | -18 | -155.5 | -26.1 | 0 | 0 | 0 | 109.5 | ||||
| 301 | Q | 26.2 | Very low | 26 | Very low | 176 Ų | 176 | 141 Ų | 141 | 82% | 0.822 | 75% | 0.753 | S | S | * | * | trans | 96.6 | 140.7 | 172.5 | -57.4 | -175.1 | 44.6 | 0 | 0 | 116.8 | ||||
| 302 | S | 27.3 | Very low | 26.1 | Very low | 84 Ų | 84 | 138.9 Ų | 138.9 | 59% | 0.587 | 75% | 0.751 | S | S | * | * | cis | -169.8 | 137.7 | -10.5 | -95.8 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 303 | K | 28 | Very low | 26.8 | Very low | 181 Ų | 181 | 137.2 Ų | 137.2 | 79% | 0.787 | 74% | 0.738 | S | S | * | * | trans | 68.1 | 160 | 151.5 | -63.3 | 178.2 | -176.8 | 177.2 | 0 | 119.2 | ||||
| 304 | D | 27.5 | Very low | 26.9 | Very low | 116 Ų | 116 | 142.7 Ų | 142.7 | 62% | 0.62 | 75% | 0.745 | S | S | * | * | cis | -175.3 | 163.3 | -16.2 | -87 | -14.2 | 0 | 0 | 0 | 106.6 | ||||
| 305 | F | 26.3 | Very low | 26.9 | Very low | 166 Ų | 166 | 140.6 Ų | 140.6 | 73% | 0.728 | 74% | 0.742 | S | S | * | * | cis | -169.8 | 141.3 | -18.5 | -112.1 | -45.2 | 0 | 0 | 0 | 112.2 | ||||
| 306 | L | 28.6 | Very low | 27 | Very low | 140 Ų | 140 | 148.1 Ų | 148.1 | 73% | 0.733 | 75% | 0.752 | S | S | * | * | trans | 66.9 | 157.5 | 153.3 | -52.9 | 174.8 | 0 | 0 | 0 | 120.1 | ||||
| 307 | N | 25.1 | Very low | 27 | Very low | 116 Ų | 116 | 147.1 Ų | 147.1 | 62% | 0.62 | 75% | 0.752 | S | S | * | * | cis | -164.4 | 155.8 | -10.4 | -122.7 | -21 | 0 | 0 | 0 | 113.7 | ||||
| 308 | K | 25.1 | Very low | 27.1 | Very low | 176 Ų | 176 | 146.2 Ų | 146.2 | 77% | 0.765 | 76% | 0.757 | S | S | * | * | trans | 31.2 | 149.1 | 146.7 | -60.3 | 175.5 | -179.2 | -178.9 | 0 | 122.1 | ||||
| 309 | T | 23.7 | Very low | 26.3 | Very low | 130 Ų | 130 | 147.9 Ų | 147.9 | 80% | 0.798 | 76% | 0.756 | S | S | * | * | -172 | 166.2 | 58.4 | -47.9 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 310 | F | 23.4 | Very low | 26.3 | Very low | 195 Ų | 195 | 148.2 Ų | 148.2 | 86% | 0.855 | 76% | 0.755 | S | S | * | * | trans | -56.7 | 154.7 | 172.4 | -75.6 | -111.9 | 0 | 0 | 0 | 116.4 | ||||
| 311 | S | 24.4 | Very low | 26.1 | Very low | 122 Ų | 122 | 148.5 Ų | 148.5 | 85% | 0.853 | 76% | 0.762 | S | S | * | * | 168.1 | 154.1 | 112.2 | -70 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 312 | D | 26.5 | Very low | 26.3 | Very low | 147 Ų | 147 | 146.2 Ų | 146.2 | 79% | 0.786 | 76% | 0.76 | S | S | * | * | trans | -124.3 | 139.7 | 159.1 | 168 | 48.7 | 0 | 0 | 0 | 107.8 | ||||
| 313 | P | 37.8 | Very low | 26.9 | Very low | 97 Ų | 97 | 147.2 Ų | 147.2 | 63% | 0.63 | 76% | 0.764 | S | S | * | * | -156.8 | 152.9 | 119.6 | 37.7 | -18.7 | 0 | 0 | 0 | 118.7 | |||||
| 314 | H | 25.6 | Very low | 26.7 | Very low | 183 Ų | 183 | 145.4 Ų | 145.4 | 85% | 0.847 | 76% | 0.763 | S | S | * | * | trans | 49 | 109.8 | 138.4 | -62.9 | -40.2 | 0 | 0 | 0 | 123.3 | ||||
| 315 | G | 24.4 | Very low | 26.4 | Very low | 74 Ų | 74 | 143.9 Ų | 143.9 | 76% | 0.763 | 76% | 0.761 | S | S | * | * | 93.8 | 161.5 | 100.4 | 0 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 316 | R | 26.2 | Very low | 26.4 | Very low | 243 Ų | 243 | 143.5 Ų | 143.5 | 92% | 0.917 | 76% | 0.761 | S | S | * | * | trans | 73.1 | 123.6 | -178.8 | -60.6 | -175 | 177 | -154.7 | -0.3 | 114.7 | ||||
| 317 | K | 24.3 | Very low | 26.2 | Very low | 200 Ų | 200 | 142.9 Ų | 142.9 | 87% | 0.87 | 76% | 0.758 | S | S | * | * | 68.6 | 116.1 | 62.9 | -77.7 | -166.5 | 174.7 | -171.6 | 0 | 114.2 | |||||
| 318 | V | 25.5 | Very low | 26.3 | Very low | 135 Ų | 135 | 147.8 Ų | 147.8 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | 179 | 159.7 | 121.7 | 147 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 319 | E | 23 | Very low | 26.4 | Very low | 138 Ų | 138 | 142.5 Ų | 142.5 | 65% | 0.645 | 76% | 0.757 | S | S | * | * | trans | -21.3 | 149.3 | -179 | -64.8 | 176.3 | 103.9 | 0 | 0 | 121.3 | ||||
| 320 | K | 25.6 | Very low | 26.4 | Very low | 163 Ų | 163 | 145.6 Ų | 145.6 | 71% | 0.709 | 76% | 0.759 | S | S | * | * | cis | 80.5 | 105.6 | 46.7 | 153.5 | -115.4 | -178.9 | 175.1 | 0 | 114.7 | ||||
| 321 | T | 24.6 | Very low | 26.5 | Very low | 137 Ų | 137 | 143.8 Ų | 143.8 | 84% | 0.84 | 75% | 0.753 | S | S | * | * | trans | -172.6 | 123.4 | 140.4 | 26.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 322 | T | 29.9 | Very low | 26.5 | Very low | 127 Ų | 127 | 145.5 Ų | 145.5 | 78% | 0.779 | 75% | 0.752 | S | S | * | * | trans | -67.7 | 167.5 | 144.5 | 42.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 323 | P | 40.3 | Very low | 26.4 | Very low | 106 Ų | 106 | 145.7 Ų | 145.7 | 69% | 0.688 | 75% | 0.748 | S | S | * | * | cis | -155.4 | -167.8 | 42.3 | 42.6 | -18.5 | 0 | 0 | 0 | 117.9 | ||||
| 324 | D | 22.3 | Very low | 25.7 | Very low | 143 Ų | 143 | 146 Ų | 146 | 77% | 0.765 | 75% | 0.752 | S | S | * | * | trans | 59.8 | 154.8 | 143 | -80.5 | 25.8 | 0 | 0 | 0 | 122.3 | ||||
| 325 | C | 22.7 | Very low | 25.6 | Very low | 84 Ų | 84 | 142.1 Ų | 142.1 | 57% | 0.568 | 75% | 0.746 | S | S | * | * | cis | -174.1 | 154.1 | -35 | -124.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 326 | Q | 26.2 | Very low | 25.6 | Very low | 158 Ų | 158 | 143.5 Ų | 143.5 | 74% | 0.738 | 75% | 0.75 | S | S | * | * | trans | 67.5 | 159.1 | 146.3 | -68 | 177.5 | 45.4 | 0 | 0 | 116.7 | ||||
| 327 | L | 24.6 | Very low | 25.5 | Very low | 127 Ų | 127 | 136.9 Ų | 136.9 | 67% | 0.665 | 75% | 0.748 | S | S | * | * | cis | -159.1 | 165.2 | -5.7 | -125.7 | 177 | 0 | 0 | 0 | 111.1 | ||||
| 328 | R | 27.2 | Very low | 25.4 | Very low | 219 Ų | 219 | 136.6 Ų | 136.6 | 83% | 0.826 | 75% | 0.75 | S | S | * | * | trans | 72.1 | 158.8 | 158.4 | -67.7 | 179.7 | -165.4 | -172.5 | 5.1 | 119.8 | ||||
| 329 | A | 25.7 | Very low | 25.4 | Very low | 64 Ų | 64 | 136.1 Ų | 136.1 | 53% | 0.529 | 75% | 0.752 | S | S | . | * | cis | 179.5 | 164.7 | -35.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 330 | F | 25 | Very low | 25.7 | Very low | 195 Ų | 195 | 136.2 Ų | 136.2 | 86% | 0.855 | 75% | 0.751 | S | S | * | * | trans | 70.5 | 119 | 167.5 | -52.8 | -67.7 | 0 | 0 | 0 | 116 | ||||
| 331 | H | 24.4 | Very low | 26.6 | Very low | 158 Ų | 158 | 133.6 Ų | 133.6 | 73% | 0.731 | 75% | 0.75 | S | S | * | * | cis | 93.5 | 111 | 13 | -146.2 | 107 | 0 | 0 | 0 | 116 | ||||
| 332 | L | 24.9 | Very low | 26.5 | Very low | 158 Ų | 158 | 135.5 Ų | 135.5 | 83% | 0.827 | 75% | 0.749 | S | S | * | * | trans | -166.4 | 122.3 | 163.3 | -96.3 | 155.1 | 0 | 0 | 0 | 104.1 | ||||
| 333 | Q | 23.7 | Very low | 26.6 | Very low | 150 Ų | 150 | 136.6 Ų | 136.6 | 70% | 0.701 | 75% | 0.745 | S | S | * | * | 56.9 | 135.2 | 53.7 | -68.1 | -173 | -49.2 | 0 | 0 | 112.7 | |||||
| 334 | S | 23 | Very low | 26.5 | Very low | 103 Ų | 103 | 139.1 Ų | 139.1 | 72% | 0.72 | 75% | 0.748 | S | S | * | * | cis | -165.9 | 179.2 | 0.7 | -118.9 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 335 | S | 24.3 | Very low | 26.8 | Very low | 102 Ų | 102 | 137.5 Ų | 137.5 | 71% | 0.713 | 74% | 0.743 | S | S | * | * | cis | -168.7 | 149.8 | -0.4 | 39.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 336 | A | 24.6 | Very low | 27.3 | Very low | 103 Ų | 103 | 139.2 Ų | 139.2 | 85% | 0.851 | 76% | 0.756 | S | S | * | * | trans | 49.3 | 127.2 | 140.6 | 0 | 0 | 0 | 0 | 0 | 124 | ||||
| 337 | A | 23.7 | Very low | 27.5 | Very low | 104 Ų | 104 | 134.6 Ų | 134.6 | 86% | 0.86 | 75% | 0.751 | S | S | * | * | trans | -159.8 | 157 | 135.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 338 | E | 23 | Very low | 27.9 | Very low | 195 Ų | 195 | 136.2 Ų | 136.2 | 91% | 0.911 | 76% | 0.759 | S | S | * | * | trans | -92.2 | 162.6 | -176.5 | -68.8 | 163.6 | 115.3 | 0 | 0 | 111.2 | ||||
| 339 | S | 24.9 | Very low | 27.7 | Very low | 125 Ų | 125 | 132.7 Ų | 132.7 | 87% | 0.874 | 76% | 0.757 | S | S | * | * | -158.5 | 165.4 | 61.6 | 54.5 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 340 | K | 28.9 | Very low | 27.8 | Very low | 140 Ų | 140 | 137.5 Ų | 137.5 | 61% | 0.609 | 76% | 0.762 | S | S | * | * | trans | -98.9 | -177.2 | 170.3 | -115.4 | -164.8 | 171.1 | -166.1 | 0 | 109.5 | E343 | K340-E343 IonicContact NZ-OE1 2.66Å; K340-E343 PolarHBondContact NZ-OE1 3.38Å; K340-E343 IonicContact NZ-OE2 3.76Å; K340-E343 PolarHBondContact NZ-OE2 3.3Å | ||
| 341 | P | 43.8 | Very low | 28.1 | Very low | 107 Ų | 107 | 135 Ų | 135 | 70% | 0.695 | 76% | 0.762 | S | S | * | * | cis | -113.2 | -160.5 | 10.6 | 35.5 | -14.3 | 0 | 0 | 0 | 110.8 | ||||
| 342 | E | 23.2 | Very low | 28.5 | Very low | 177 Ų | 177 | 130.3 Ų | 130.3 | 83% | 0.827 | 75% | 0.747 | S | S | * | * | cis | -123.3 | -150.5 | 9.2 | -64.9 | -174.7 | 114.7 | 0 | 0 | 112.9 | ||||
| 343 | E | 31.4 | Very low | 29.2 | Very low | 150 Ų | 150 | 130.2 Ų | 130.2 | 70% | 0.701 | 75% | 0.753 | S | S | * | * | trans | -149.4 | 173.5 | -144.5 | -148.3 | 107.1 | -128.4 | 0 | 0 | 117.4 | K340 | K340-E343 IonicContact NZ-OE1 2.66Å; K340-E343 PolarHBondContact NZ-OE1 3.38Å; K340-E343 IonicContact NZ-OE2 3.76Å; K340-E343 PolarHBondContact NZ-OE2 3.3Å | ||
| 344 | Q | 38.1 | Very low | 30.3 | Very low | 160 Ų | 160 | 127.1 Ų | 127.1 | 75% | 0.748 | 74% | 0.739 | S | S | * | * | trans | -92.1 | -169.7 | -171.5 | -59.6 | 169.8 | -17.2 | 0 | 0 | 111.9 | ||||
| 345 | V | 29.5 | Very low | 31.2 | Very low | 109 Ų | 109 | 123.6 Ų | 123.6 | 66% | 0.661 | 72% | 0.719 | S | S | * | * | -138.7 | 127.4 | 80.7 | -179.3 | 0 | 0 | 0 | 0 | 113.1 | L348 | V345-L348 HydrophobicContact CG1-CD2 4.39Å; V345-L348 HydrophobicContact CG1-CG 4.47Å | |||
| 346 | S | 32.5 | Very low | 32.7 | Very low | 119 Ų | 119 | 124.6 Ų | 124.6 | 83% | 0.832 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -147.6 | 82.3 | 151.7 | -84.6 | 0 | 0 | 0 | 0 | 108.7 | ||
| 347 | G | 30.9 | Very low | 34.3 | Very low | 61 Ų | 61 | 126.8 Ų | 126.8 | 63% | 0.629 | 72% | 0.715 | S | S | * | * | trans | 148.6 | 110.6 | -172.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 348 | L | 32.5 | Very low | 36.1 | Very low | 161 Ų | 161 | 125.6 Ų | 125.6 | 84% | 0.843 | 69% | 0.692 | S | S | * | * | trans | -107.7 | 112.3 | 167.3 | -74.7 | 174.1 | 0 | 0 | 0 | 108.6 | V345 W350 | V345-L348 HydrophobicContact CG1-CD2 4.39Å; V345-L348 HydrophobicContact CG1-CG 4.47Å; L348-W350 PolarHBondContact O-N 2.86Å | ||
| 349 | N | 23.5 | Very low | 38 | Very low | 146 Ų | 146 | 124.8 Ų | 124.8 | 78% | 0.781 | 68% | 0.681 | S | S | * | * | trans | -55.6 | 131 | 156.4 | -80 | -40.5 | 0 | 0 | 0 | 107.8 | T351 | N349-T351 PolarHBondContact O-N 2.93Š| ||
| 350 | W | 28.2 | Very low | 40.4 | Very low | 165 Ų | 165 | 121.3 Ų | 121.3 | 63% | 0.625 | 66% | 0.657 | S | S | * | * | trans | -70.7 | 97.7 | 166.2 | -171.5 | -90.2 | 0 | 0 | 0 | 107.3 | L348 S352 | L348-W350 PolarHBondContact O-N 2.86Å; W350-S352 PolarHBondContact O-N 2.69Å | ||
| 351 | T | 32.1 | Very low | 43 | Very low | 141 Ų | 141 | 120.4 Ų | 120.4 | 87% | 0.865 | 65% | 0.654 | S | S | * | * | trans | -75.9 | 65.4 | 177.7 | 52.6 | 0 | 0 | 0 | 0 | 110.9 | N349 | N349-T351 PolarHBondContact O-N 2.93Š| ||
| 352 | S | 32.4 | Very low | 44.7 | Very low | 60 Ų | 60 | 120 Ų | 120 | 42% | 0.42 | 64% | 0.64 | S | S | . | * | S | Bend | trans | -146.6 | 138.7 | 163.1 | -166.5 | 0 | 0 | 0 | 0 | 107.4 | W350 Q354 | W350-S352 PolarHBondContact O-N 2.69Å; S352-Q354 PolarHBondContact O-N 3.11Å; S352-Q354 VanDerWaalsContact OG-CD 3.31Å; S352-Q354 WeakPolarHBondContact OG-CG 3.47Å; S352-Q354 PolarHBondContact OG-OE1 3.42Å; S352-Q354 VanDerWaalsContact OG-OE1 3.05Å |
| 353 | T | 40.1 | Very low | 47.5 | Very low | 156 Ų | 156 | 115.9 Ų | 115.9 | 96% | 0.957 | 62% | 0.623 | S | S | * | * | trans | -77 | 61.4 | -172.7 | -44 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 354 | Q | 45.8 | Very low | 50 | Low | 86 Ų | 86 | 114.4 Ų | 114.4 | 40% | 0.402 | 61% | 0.614 | S | S | . | * | trans | -114.3 | 133.9 | -165.8 | -68.1 | -173.6 | -74.4 | 0 | 0 | 111.4 | S352 E358 | S352-Q354 PolarHBondContact O-N 3.11Å; S352-Q354 VanDerWaalsContact OG-CD 3.31Å; S352-Q354 WeakPolarHBondContact OG-CG 3.47Å; S352-Q354 PolarHBondContact OG-OE1 3.42Å; S352-Q354 VanDerWaalsContact OG-OE1 3.05Å; Q354-E358 WeakPolarHBondContact CA-OE1 3.17Å; Q354-E358 HydrophobicContact CB-CB 4.03Å; Q354-E358 HydrophobicContact CB-CG 4.46Å; Q354-E358 WeakPolarHBondContact CB-OE1 3.38Å; Q354-E358 VanDerWaalsContact CG-OE2 3.28Å; Q354-E358 WeakPolarHBondContact CG-OE2 3.36Å; Q354-E358 PolarHBondContact NE2-OE2 3.2Å | ||
| 355 | G | 42.1 | Very low | 52.2 | Low | 28 Ų | 28 | 111.8 Ų | 111.8 | 29% | 0.289 | 60% | 0.6 | S | S | . | * | trans | -70.9 | 169 | -167.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | E357 E358 R359 | G355-E357 PolarHBondContact O-N 3.37Å; G355-E357 VanDerWaalsContact O-N 3.1Å; G355-E358 PolarHBondContact N-OE1 3.44Å; G355-E358 PolarHBondContact O-N 3.17Å; G355-R359 PolarHBondContact O-N 2.97Å | ||
| 356 | P | 55.9 | Low | 54.9 | Low | 124 Ų | 124 | 107.4 Ų | 107.4 | 81% | 0.805 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -57.3 | -23.9 | 168.6 | 25.6 | -34.4 | 0 | 0 | 0 | 112.4 | S360 | P356-S360 PolarHBondContact O-N 3.15Å; P356-S360 VanDerWaalsContact O-N 3.14Å |
| 357 | E | 58.3 | Low | 57.5 | Low | 148 Ų | 148 | 107.6 Ų | 107.6 | 69% | 0.692 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -66.9 | -46.8 | 173.2 | -166.3 | 151.8 | -139.2 | 0 | 0 | 112.3 | G355 R359 S360 E361 | G355-E357 PolarHBondContact O-N 3.37Å; G355-E357 VanDerWaalsContact O-N 3.1Å; E357-R359 PolarHBondContact O-N 2.71Å; E357-S360 CarbonylContact O-C 3.52Å; E357-S360 WeakPolarHBondContact O-CA 3.26Å; E357-S360 WeakPolarHBondContact O-CB 3.33Å; E357-S360 PolarHBondContact O-N 2.7Å; E357-E361 PolarHBondContact O-N 2.91Å |
| 358 | E | 60.5 | Low | 60.3 | Low | 80 Ų | 80 | 107.8 Ų | 107.8 | 37% | 0.374 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -69.4 | -33.9 | 178.5 | -69.2 | 170.4 | -86 | 0 | 0 | 112.4 | Q354 G355 S360 E361 Y362 | Q354-E358 WeakPolarHBondContact CA-OE1 3.17Å; Q354-E358 HydrophobicContact CB-CB 4.03Å; Q354-E358 HydrophobicContact CB-CG 4.46Å; Q354-E358 WeakPolarHBondContact CB-OE1 3.38Å; Q354-E358 VanDerWaalsContact CG-OE2 3.28Å; Q354-E358 WeakPolarHBondContact CG-OE2 3.36Å; Q354-E358 PolarHBondContact NE2-OE2 3.2Å; G355-E358 PolarHBondContact N-OE1 3.44Å; G355-E358 PolarHBondContact O-N 3.17Å; E358-S360 VanDerWaalsContact C-N 3.25Å; E358-S360 PolarHBondContact O-N 3.49Å; E358-E361 PolarHBondContact O-N 3.18Å; E358-E361 VanDerWaalsContact O-N 3.15Å; E358-Y362 PolarHBondContact O-N 3.13Å |
| 359 | R | 64.4 | Low | 62.9 | Low | 178 Ų | 178 | 100.6 Ų | 100.6 | 67% | 0.672 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.6 | -33.6 | 168.6 | -169.1 | 176.7 | -180 | 92.4 | -1.6 | 111.6 | G355 E357 L363 | G355-R359 PolarHBondContact O-N 2.97Å; E357-R359 PolarHBondContact O-N 2.71Å; R359-L363 WeakPolarHBondContact O-CG 3.39Å; R359-L363 PolarHBondContact O-N 2.77Å; R359-L363 VanDerWaalsContact O-N 3.16Å |
| 360 | S | 74.6 | Confident | 66.1 | Low | 52 Ų | 52 | 94.5 Ų | 94.5 | 36% | 0.364 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67.2 | -39.8 | 171.4 | -164.9 | 0 | 0 | 0 | 0 | 111.4 | P356 E357 E358 L363 K364 | P356-S360 PolarHBondContact O-N 3.15Å; P356-S360 VanDerWaalsContact O-N 3.14Å; E357-S360 CarbonylContact O-C 3.52Å; E357-S360 WeakPolarHBondContact O-CA 3.26Å; E357-S360 WeakPolarHBondContact O-CB 3.33Å; E357-S360 PolarHBondContact O-N 2.7Å; E358-S360 VanDerWaalsContact C-N 3.25Å; E358-S360 PolarHBondContact O-N 3.49Å; S360-L363 PolarHBondContact O-N 2.88Å; S360-K364 WeakPolarHBondContact O-CD 3.5Å; S360-K364 WeakPolarHBondContact O-CG 3.37Å; S360-K364 PolarHBondContact O-N 3.25Å; S360-K364 WeakPolarHBondContact OG-CE 3.25Å; S360-K364 PolarHBondContact OG-NZ 3.26Å |
| 361 | E | 82.4 | Confident | 69 | Low | 120 Ų | 120 | 90.8 Ų | 90.8 | 56% | 0.561 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -67.6 | -41.3 | 175.7 | -63.7 | -158.4 | 148.2 | 0 | 0 | 113.4 | E357 E358 L363 K364 K365 | E357-E361 PolarHBondContact O-N 2.91Å; E358-E361 PolarHBondContact O-N 3.18Å; E358-E361 VanDerWaalsContact O-N 3.15Å; E361-L363 VanDerWaalsContact C-N 3.34Å; E361-L363 PolarHBondContact O-N 2.82Å; E361-K364 PolarHBondContact O-N 3.23Å; E361-K365 WeakPolarHBondContact O-CB 3.34Å; E361-K365 PolarHBondContact O-N 3Å |
| 362 | Y | 81.1 | Confident | 71.8 | Confident | 99 Ų | 99 | 85.1 Ų | 85.1 | 39% | 0.388 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -59.9 | -44.1 | 172.9 | -179.1 | -96.4 | 0 | 0 | 0 | 111.6 | E358 K364 K365 V366 | E358-Y362 PolarHBondContact O-N 3.13Å; Y362-K364 PolarHBondContact O-N 2.96Å; Y362-K365 WeakPolarHBondContact O-CB 3.32Å; Y362-K365 PolarHBondContact O-N 3.31Å; Y362-V366 HydrophobicContact CD1-CG2 4.1Å; Y362-V366 HydrophobicContact CE1-CG2 3.59Å; Y362-V366 HydrophobicContact CE2-CG2 4.29Å; Y362-V366 WeakPolarHBondContact O-CG2 3.39Å; Y362-V366 PolarHBondContact O-N 2.96Å |
| 363 | L | 81.6 | Confident | 74.6 | Confident | 91 Ų | 91 | 82.3 Ų | 82.3 | 48% | 0.476 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -64.8 | -36.1 | 175.6 | -73.5 | 168 | 0 | 0 | 0 | 112.7 | R359 S360 E361 K367 | R359-L363 WeakPolarHBondContact O-CG 3.39Å; R359-L363 PolarHBondContact O-N 2.77Å; R359-L363 VanDerWaalsContact O-N 3.16Å; S360-L363 PolarHBondContact O-N 2.88Å; E361-L363 VanDerWaalsContact C-N 3.34Å; E361-L363 PolarHBondContact O-N 2.82Å; L363-K367 WeakPolarHBondContact O-CB 3.33Å; L363-K367 WeakPolarHBondContact O-CG 3.38Å; L363-K367 PolarHBondContact O-N 2.99Å |
| 364 | K | 84.4 | Confident | 77 | Confident | 119 Ų | 119 | 78.4 Ų | 78.4 | 52% | 0.517 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -65.8 | -41.2 | 171.1 | -67.8 | 161 | -157.3 | 157.3 | 0 | 111.3 | S360 E361 Y362 K367 S368 | S360-K364 WeakPolarHBondContact O-CD 3.5Å; S360-K364 WeakPolarHBondContact O-CG 3.37Å; S360-K364 PolarHBondContact O-N 3.25Å; S360-K364 WeakPolarHBondContact OG-CE 3.25Å; S360-K364 PolarHBondContact OG-NZ 3.26Å; E361-K364 PolarHBondContact O-N 3.23Å; Y362-K364 PolarHBondContact O-N 2.96Å; K364-K367 PolarHBondContact O-N 3.22Å; K364-S368 VanDerWaalsContact O-CB 3.3Å; K364-S368 WeakPolarHBondContact O-CB 3.47Å; K364-S368 PolarHBondContact O-N 3.07Å |
| 365 | K | 84.4 | Confident | 79.1 | Confident | 104 Ų | 104 | 79.7 Ų | 79.7 | 45% | 0.452 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -62.6 | -48.4 | 176.2 | -173.3 | -176.9 | 178.7 | -175.7 | 0 | 110.8 | E361 Y362 S368 I369 | E361-K365 WeakPolarHBondContact O-CB 3.34Å; E361-K365 PolarHBondContact O-N 3Å; Y362-K365 WeakPolarHBondContact O-CB 3.32Å; Y362-K365 PolarHBondContact O-N 3.31Å; K365-S368 WeakPolarHBondContact O-CB 3.39Å; K365-S368 PolarHBondContact O-N 3.41Å; K365-I369 HydrophobicContact CG-CD1 3.98Å; K365-I369 WeakPolarHBondContact O-CB 3.43Å; K365-I369 VanDerWaalsContact O-CG1 3.3Å; K365-I369 WeakPolarHBondContact O-CG1 3.43Å; K365-I369 PolarHBondContact O-N 2.8Å |
| 366 | V | 85.6 | Confident | 81.4 | Confident | 18 Ų | 18 | 79 Ų | 79 | 11% | 0.109 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -57.4 | -50.2 | 174.1 | 162.2 | 0 | 0 | 0 | 0 | 111.1 | Y362 S368 I369 L370 V392 | Y362-V366 HydrophobicContact CD1-CG2 4.1Å; Y362-V366 HydrophobicContact CE1-CG2 3.59Å; Y362-V366 HydrophobicContact CE2-CG2 4.29Å; Y362-V366 WeakPolarHBondContact O-CG2 3.39Å; Y362-V366 PolarHBondContact O-N 2.96Å; V366-S368 VanDerWaalsContact C-N 3.29Å; V366-S368 PolarHBondContact O-N 3.31Å; V366-I369 PolarHBondContact O-N 3.13Å; V366-L370 HydrophobicContact CG1-CD1 3.75Å; V366-L370 HydrophobicContact CG1-CG 4.39Å; V366-L370 WeakPolarHBondContact O-CB 3.34Å; V366-L370 VanDerWaalsContact O-CG 3.25Å; V366-L370 WeakPolarHBondContact O-CG 3.34Å; V366-L370 PolarHBondContact O-N 2.91Å; V366-V392 HydrophobicContact CG1-CG1 4.14Å |
| 367 | K | 87.1 | Confident | 83 | Confident | 122 Ų | 122 | 76.7 Ų | 76.7 | 53% | 0.53 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64 | -32.2 | 177.5 | -70.5 | -165.6 | 175.1 | -147 | 0 | 112.8 | L363 K364 N371 E395 | L363-K367 WeakPolarHBondContact O-CB 3.33Å; L363-K367 WeakPolarHBondContact O-CG 3.38Å; L363-K367 PolarHBondContact O-N 2.99Å; K364-K367 PolarHBondContact O-N 3.22Å; K367-N371 WeakPolarHBondContact O-CB 3.32Å; K367-N371 PolarHBondContact O-N 2.91Å; K367-E395 IonicContact NZ-OE1 3.94Å; K367-E395 PolarHBondContact NZ-OE1 2.9Å |
| 368 | S | 88.8 | Confident | 84.2 | Confident | 66 Ų | 66 | 71.9 Ų | 71.9 | 46% | 0.462 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -67.6 | -45.4 | 172.4 | -168.9 | 0 | 0 | 0 | 0 | 112.4 | K364 K365 V366 N371 I372 | K364-S368 VanDerWaalsContact O-CB 3.3Å; K364-S368 WeakPolarHBondContact O-CB 3.47Å; K364-S368 PolarHBondContact O-N 3.07Å; K365-S368 WeakPolarHBondContact O-CB 3.39Å; K365-S368 PolarHBondContact O-N 3.41Å; V366-S368 VanDerWaalsContact C-N 3.29Å; V366-S368 PolarHBondContact O-N 3.31Å; S368-N371 PolarHBondContact O-N 2.92Å; S368-N371 VanDerWaalsContact O-N 3.15Å; S368-I372 WeakPolarHBondContact O-CG1 3.47Å; S368-I372 PolarHBondContact O-N 3.37Å |
| 369 | I | 88.6 | Confident | 85.4 | Confident | 10 Ų | 10 | 72.7 Ų | 72.7 | 5% | 0.051 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -58.3 | -50.5 | 174.8 | -72.8 | 168.7 | 0 | 0 | 0 | 110.4 | K365 V366 N371 I372 V373 L384 A386 L389 V392 L400 | K365-I369 HydrophobicContact CG-CD1 3.98Å; K365-I369 WeakPolarHBondContact O-CB 3.43Å; K365-I369 VanDerWaalsContact O-CG1 3.3Å; K365-I369 WeakPolarHBondContact O-CG1 3.43Å; K365-I369 PolarHBondContact O-N 2.8Å; V366-I369 PolarHBondContact O-N 3.13Å; I369-N371 VanDerWaalsContact C-N 3.25Å; I369-N371 PolarHBondContact O-N 2.94Å; I369-I372 PolarHBondContact O-N 3.17Å; I369-V373 WeakPolarHBondContact O-CG2 3.5Å; I369-V373 PolarHBondContact O-N 3.06Å; I369-V373 VanDerWaalsContact O-N 3.09Å; I369-L384 HydrophobicContact CB-CD1 4.17Å; I369-L384 HydrophobicContact CG1-CD1 3.78Å; I369-L384 HydrophobicContact CG1-CG 4.1Å; I369-L384 HydrophobicContact CG2-CD1 4.04Å; I369-L384 HydrophobicContact CG2-CD2 4.04Å; I369-L384 HydrophobicContact CG2-CG 4.08Å; I369-A386 HydrophobicContact CD1-CB 4.43Å; I369-L389 HydrophobicContact CG2-CD2 4.49Å; I369-V392 HydrophobicContact CG2-CG1 4.06Å; I369-L400 HydrophobicContact CG2-CD1 3.9Å; I369-L400 HydrophobicContact CG2-CD2 3.99Å |
| 370 | L | 89 | Confident | 86.3 | Confident | 17 Ų | 17 | 67.2 Ų | 67.2 | 9% | 0.089 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -57.4 | -38.7 | 175.6 | -68.6 | 167.4 | 0 | 0 | 0 | 111.6 | V366 K374 V392 D394 L400 I403 | V366-L370 HydrophobicContact CG1-CD1 3.75Å; V366-L370 HydrophobicContact CG1-CG 4.39Å; V366-L370 WeakPolarHBondContact O-CB 3.34Å; V366-L370 VanDerWaalsContact O-CG 3.25Å; V366-L370 WeakPolarHBondContact O-CG 3.34Å; V366-L370 PolarHBondContact O-N 2.91Å; L370-K374 WeakPolarHBondContact O-CB 3.26Å; L370-K374 VanDerWaalsContact O-CG 3.26Å; L370-K374 WeakPolarHBondContact O-CG 3.43Å; L370-K374 PolarHBondContact O-N 3.34Å; L370-V392 HydrophobicContact CD2-CG1 4.09Å; L370-V392 HydrophobicContact CG-CG1 4.14Å; L370-D394 HydrophobicContact CD1-CB 4.38Å; L370-D394 HydrophobicContact CD2-CB 4.18Å; L370-L400 HydrophobicContact CD2-CD2 3.76Å; L370-I403 HydrophobicContact CD2-CD1 3.31Å |
| 371 | N | 90.2 | Very high | 86.4 | Confident | 88 Ų | 88 | 64.9 Ų | 64.9 | 47% | 0.471 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -71 | -41.1 | 177.3 | -157.8 | 101.3 | 0 | 0 | 0 | 112.6 | K367 S368 I369 V373 K374 E375 | K367-N371 WeakPolarHBondContact O-CB 3.32Å; K367-N371 PolarHBondContact O-N 2.91Å; S368-N371 PolarHBondContact O-N 2.92Å; S368-N371 VanDerWaalsContact O-N 3.15Å; I369-N371 VanDerWaalsContact C-N 3.25Å; I369-N371 PolarHBondContact O-N 2.94Å; N371-V373 VanDerWaalsContact C-N 3.26Å; N371-V373 PolarHBondContact O-N 3.48Å; N371-K374 PolarHBondContact O-N 2.95Å; N371-E375 WeakPolarHBondContact ND2-CG 3.25Å; N371-E375 WeakPolarHBondContact O-CB 3.48Å; N371-E375 VanDerWaalsContact O-CG 3.27Å; N371-E375 WeakPolarHBondContact O-CG 3.5Å; N371-E375 PolarHBondContact O-N 3.43Å |
| 372 | I | 90.1 | Very high | 85.9 | Confident | 22 Ų | 22 | 63.9 Ų | 63.9 | 11% | 0.113 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -56.6 | -42.7 | 175.3 | -74.2 | 164.4 | 0 | 0 | 0 | 110.6 | S368 I369 G376 Q377 L380 L381 L384 | S368-I372 WeakPolarHBondContact O-CG1 3.47Å; S368-I372 PolarHBondContact O-N 3.37Å; I369-I372 PolarHBondContact O-N 3.17Å; I372-G376 PolarHBondContact O-N 2.86Å; I372-G376 VanDerWaalsContact O-N 3.15Å; I372-Q377 HydrophobicContact CG2-CB 4.21Å; I372-Q377 PolarHBondContact O-N 3.37Å; I372-L380 HydrophobicContact CD1-CB 4.27Å; I372-L380 HydrophobicContact CD1-CD1 4.2Å; I372-L380 HydrophobicContact CG1-CB 4.49Å; I372-L380 HydrophobicContact CG1-CD1 4.08Å; I372-L380 HydrophobicContact CG2-CB 3.92Å; I372-L381 HydrophobicContact CG2-CD2 4.19Å; I372-L384 HydrophobicContact CB-CD1 4.28Å; I372-L384 HydrophobicContact CD1-CD1 3.98Å; I372-L384 HydrophobicContact CG2-CD1 3.95Å |
| 373 | V | 91.1 | Very high | 85.2 | Confident | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -74.1 | -40 | 178 | -179.5 | 0 | 0 | 0 | 0 | 112 | I369 N371 E375 G376 L381 L384 L400 I403 A404 H409 L416 | I369-V373 WeakPolarHBondContact O-CG2 3.5Å; I369-V373 PolarHBondContact O-N 3.06Å; I369-V373 VanDerWaalsContact O-N 3.09Å; N371-V373 VanDerWaalsContact C-N 3.26Å; N371-V373 PolarHBondContact O-N 3.48Å; V373-E375 VanDerWaalsContact C-N 3.29Å; V373-E375 PolarHBondContact O-N 3.44Å; V373-G376 PolarHBondContact O-N 3.44Å; V373-G376 VanDerWaalsContact O-N 3.1Å; V373-L381 HydrophobicContact CG2-CD2 4.16Å; V373-L384 HydrophobicContact CG2-CD2 4.44Å; V373-L400 WeakPolarHBondContact CG1-O 3.46Å; V373-L400 HydrophobicContact CG2-CD2 4.26Å; V373-I403 HydrophobicContact CB-CG2 4.38Å; V373-I403 HydrophobicContact CG1-CB 4.17Å; V373-I403 HydrophobicContact CG1-CG2 3.86Å; V373-A404 HydrophobicContact CG1-CB 3.89Å; V373-H409 PolarHBondContact O-CD2 2.87Å; V373-L416 HydrophobicContact CB-CD1 4.48Å; V373-L416 HydrophobicContact CG1-CD1 3.68Å; V373-L416 HydrophobicContact CG2-CD1 3.9Å; V373-L416 HydrophobicContact CG2-CD2 4.37Å |
| 374 | K | 90.8 | Very high | 84.7 | Confident | 74 Ų | 74 | 62.7 Ų | 62.7 | 32% | 0.322 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -60.9 | -36.9 | 174.8 | -76.3 | 178.7 | -175.5 | -166.8 | 0 | 112.5 | L370 N371 D394 I403 Q407 H409 | L370-K374 WeakPolarHBondContact O-CB 3.26Å; L370-K374 VanDerWaalsContact O-CG 3.26Å; L370-K374 WeakPolarHBondContact O-CG 3.43Å; L370-K374 PolarHBondContact O-N 3.34Å; N371-K374 PolarHBondContact O-N 2.95Å; K374-D394 IonicContact NZ-OD2 2.72Å; K374-D394 PolarHBondContact NZ-OD2 3.5Å; K374-I403 HydrophobicContact CB-CG2 4.37Å; K374-I403 HydrophobicContact CD-CG2 4.24Å; K374-I403 HydrophobicContact CG-CG2 3.33Å; K374-Q407 PolarHBondContact O-NE2 3.47Å; K374-H409 PolarHBondContact O-NE2 3.07Å |
| 375 | E | 91.2 | Very high | 83.4 | Confident | 114 Ų | 114 | 61.3 Ų | 61.3 | 53% | 0.533 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.9 | -2.8 | 176.3 | -63.6 | -67.2 | 141.2 | 0 | 0 | 114 | N371 V373 Q377 | N371-E375 WeakPolarHBondContact ND2-CG 3.25Å; N371-E375 WeakPolarHBondContact O-CB 3.48Å; N371-E375 VanDerWaalsContact O-CG 3.27Å; N371-E375 WeakPolarHBondContact O-CG 3.5Å; N371-E375 PolarHBondContact O-N 3.43Å; V373-E375 VanDerWaalsContact C-N 3.29Å; V373-E375 PolarHBondContact O-N 3.44Å; E375-Q377 VanDerWaalsContact C-N 3.3Å; E375-Q377 HydrophobicContact CB-CG 3.79Å; E375-Q377 PolarHBondContact O-N 2.93Å |
| 376 | G | 89.8 | Confident | 82.4 | Confident | 12 Ų | 12 | 57.3 Ų | 57.3 | 12% | 0.124 | 32% | 0.321 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 65.9 | 27.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | I372 V373 I378 H409 | I372-G376 PolarHBondContact O-N 2.86Å; I372-G376 VanDerWaalsContact O-N 3.15Å; V373-G376 PolarHBondContact O-N 3.44Å; V373-G376 VanDerWaalsContact O-N 3.1Å; G376-I378 VanDerWaalsContact C-N 3.26Å; G376-I378 PolarHBondContact O-N 3.43Å; G376-H409 WeakPolarHBondContact CA-CD2 3.43Å; G376-H409 WeakPolarHBondContact CA-NE2 3.33Å; G376-H409 PolarHBondContact N-CD2 3.46Å; G376-H409 PolarHBondContact N-NE2 3.07Å |
| 377 | Q | 88.1 | Confident | 81.4 | Confident | 76 Ų | 76 | 63.6 Ų | 63.6 | 36% | 0.355 | 35% | 0.354 | S | S | . | . | trans | -80.1 | 70.5 | -170.5 | -66.4 | 179.7 | 16.8 | 0 | 0 | 112 | I372 E375 S379 L380 | I372-Q377 HydrophobicContact CG2-CB 4.21Å; I372-Q377 PolarHBondContact O-N 3.37Å; E375-Q377 VanDerWaalsContact C-N 3.3Å; E375-Q377 HydrophobicContact CB-CG 3.79Å; E375-Q377 PolarHBondContact O-N 2.93Å; Q377-S379 PolarHBondContact O-N 3.06Å; Q377-S379 VanDerWaalsContact O-N 3.1Å; Q377-L380 HydrophobicContact CB-CD1 4.34Å; Q377-L380 HydrophobicContact CB-CG 4.48Å; Q377-L380 PolarHBondContact O-N 2.87Å | ||
| 378 | I | 84.6 | Confident | 80.7 | Confident | 48 Ų | 48 | 61.6 Ų | 61.6 | 25% | 0.246 | 35% | 0.349 | C | S | . | . | G | 310 helix | trans | -50.1 | -38 | -175.8 | -65.9 | 145.5 | 0 | 0 | 0 | 113 | G376 L380 L381 P382 E411 C412 | G376-I378 VanDerWaalsContact C-N 3.26Å; G376-I378 PolarHBondContact O-N 3.43Å; I378-L380 PolarHBondContact O-N 3.5Å; I378-L380 VanDerWaalsContact O-N 3.12Å; I378-L381 HydrophobicContact CB-CD1 4.31Å; I378-L381 HydrophobicContact CG1-CD1 4.23Å; I378-L381 HydrophobicContact CG2-CD1 4.39Å; I378-L381 WeakPolarHBondContact O-CB 3.47Å; I378-L381 PolarHBondContact O-N 2.93Å; I378-P382 VanDerWaalsContact O-CD 3.25Å; I378-P382 WeakPolarHBondContact O-CD 3.3Å; I378-E411 HydrophobicContact CD1-CB 3.56Å; I378-E411 HydrophobicContact CG1-CB 4.35Å; I378-C412 HydrophobicContact CG1-CB 3.92Å |
| 379 | S | 85.6 | Confident | 80.4 | Confident | 96 Ų | 96 | 59.1 Ų | 59.1 | 67% | 0.671 | 33% | 0.331 | S | S | * | . | G | 310 helix | trans | -62.8 | -16.6 | 178.2 | 55.7 | 0 | 0 | 0 | 0 | 114.7 | Q377 | Q377-S379 PolarHBondContact O-N 3.06Å; Q377-S379 VanDerWaalsContact O-N 3.1Å |
| 380 | L | 82.4 | Confident | 80.1 | Confident | 64 Ų | 64 | 61.4 Ų | 61.4 | 34% | 0.335 | 34% | 0.343 | S | S | . | . | G | 310 helix | trans | -100 | -9.7 | 175.2 | -57.1 | -177.2 | 0 | 0 | 0 | 112.9 | I372 Q377 I378 H383 L384 | I372-L380 HydrophobicContact CD1-CB 4.27Å; I372-L380 HydrophobicContact CD1-CD1 4.2Å; I372-L380 HydrophobicContact CG1-CB 4.49Å; I372-L380 HydrophobicContact CG1-CD1 4.08Å; I372-L380 HydrophobicContact CG2-CB 3.92Å; Q377-L380 HydrophobicContact CB-CD1 4.34Å; Q377-L380 HydrophobicContact CB-CG 4.48Å; Q377-L380 PolarHBondContact O-N 2.87Å; I378-L380 PolarHBondContact O-N 3.5Å; I378-L380 VanDerWaalsContact O-N 3.12Å; L380-H383 CarbonylContact O-C 3.44Å; L380-H383 WeakPolarHBondContact O-CA 3.21Å; L380-H383 WeakPolarHBondContact O-CB 3.49Å; L380-H383 PolarHBondContact O-N 3.36Å; L380-L384 PolarHBondContact O-N 3.38Å |
| 381 | L | 77.9 | Confident | 79.8 | Confident | 3 Ų | 3 | 66.2 Ų | 66.2 | 2% | 0.016 | 36% | 0.363 | C | S | . | . | G | 310 helix | trans | -61.8 | -38.8 | 175.9 | -57.5 | 174.9 | 0 | 0 | 0 | 113.1 | I372 V373 I378 H383 L384 C412 H415 L416 | I372-L381 HydrophobicContact CG2-CD2 4.19Å; V373-L381 HydrophobicContact CG2-CD2 4.16Å; I378-L381 HydrophobicContact CB-CD1 4.31Å; I378-L381 HydrophobicContact CG1-CD1 4.23Å; I378-L381 HydrophobicContact CG2-CD1 4.39Å; I378-L381 WeakPolarHBondContact O-CB 3.47Å; I378-L381 PolarHBondContact O-N 2.93Å; L381-H383 PolarHBondContact O-N 3.27Å; L381-L384 HydrophobicContact CD2-CD2 3.91Å; L381-L384 WeakPolarHBondContact O-CB 3.3Å; L381-L384 PolarHBondContact O-N 3.3Å; L381-C412 HydrophobicContact CD1-CB 4.21Å; L381-H415 HydrophobicContact CD1-CB 3.86Å; L381-L416 HydrophobicContact CD1-CG 4.49Å; L381-L416 HydrophobicContact CD2-CD2 4.09Å; L381-L416 HydrophobicContact CD2-CG 4.3Å |
| 382 | P | 72.6 | Confident | 79.7 | Confident | 98 Ų | 98 | 62.2 Ų | 62.2 | 64% | 0.636 | 34% | 0.342 | S | S | * | . | G | 310 helix | trans | -64.8 | -17.7 | 171.5 | -23.7 | 35.4 | 0 | 0 | 0 | 114.2 | I378 | I378-P382 VanDerWaalsContact O-CD 3.25Å; I378-P382 WeakPolarHBondContact O-CD 3.3Å |
| 383 | H | 66 | Low | 79.6 | Confident | 157 Ų | 157 | 65.2 Ų | 65.2 | 73% | 0.727 | 36% | 0.355 | S | S | * | . | G | 310 helix | trans | -96.7 | -3.1 | 173.7 | -61 | -47.6 | 0 | 0 | 0 | 112.8 | L380 L381 A385 | L380-H383 CarbonylContact O-C 3.44Å; L380-H383 WeakPolarHBondContact O-CA 3.21Å; L380-H383 WeakPolarHBondContact O-CB 3.49Å; L380-H383 PolarHBondContact O-N 3.36Å; L381-H383 PolarHBondContact O-N 3.27Å; H383-A385 PolarHBondContact O-N 3.48Å |
| 384 | L | 69.7 | Low | 79.6 | Confident | 8 Ų | 8 | 66.4 Ų | 66.4 | 4% | 0.042 | 36% | 0.362 | C | S | . | . | trans | -77.7 | 6.8 | 174.8 | -142.6 | 82 | 0 | 0 | 0 | 112.6 | I369 I372 V373 L380 L381 A386 L389 L400 L416 | I369-L384 HydrophobicContact CB-CD1 4.17Å; I369-L384 HydrophobicContact CG1-CD1 3.78Å; I369-L384 HydrophobicContact CG1-CG 4.1Å; I369-L384 HydrophobicContact CG2-CD1 4.04Å; I369-L384 HydrophobicContact CG2-CD2 4.04Å; I369-L384 HydrophobicContact CG2-CG 4.08Å; I372-L384 HydrophobicContact CB-CD1 4.28Å; I372-L384 HydrophobicContact CD1-CD1 3.98Å; I372-L384 HydrophobicContact CG2-CD1 3.95Å; V373-L384 HydrophobicContact CG2-CD2 4.44Å; L380-L384 PolarHBondContact O-N 3.38Å; L381-L384 HydrophobicContact CD2-CD2 3.91Å; L381-L384 WeakPolarHBondContact O-CB 3.3Å; L381-L384 PolarHBondContact O-N 3.3Å; L384-A386 VanDerWaalsContact C-N 3.25Å; L384-A386 PolarHBondContact O-N 3.27Å; L384-L389 HydrophobicContact CD2-CD1 4.4Å; L384-L389 HydrophobicContact CD2-CD2 4.05Å; L384-L389 HydrophobicContact CG-CD2 4.26Å; L384-L400 HydrophobicContact CD2-CD1 4.33Å; L384-L416 HydrophobicContact CD2-CD2 3.94Å | ||
| 385 | A | 58.7 | Low | 79.5 | Confident | 91 Ų | 91 | 70.8 Ų | 70.8 | 75% | 0.752 | 38% | 0.383 | S | S | * | . | trans | -58.3 | 84.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | H383 | H383-A385 PolarHBondContact O-N 3.48Š| ||
| 386 | A | 62.7 | Low | 79.5 | Confident | 20 Ų | 20 | 69.4 Ų | 69.4 | 17% | 0.165 | 38% | 0.38 | C | S | . | . | trans | -125.3 | 127.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 106.2 | I369 L384 N388 L389 | I369-A386 HydrophobicContact CD1-CB 4.43Å; L384-A386 VanDerWaalsContact C-N 3.25Å; L384-A386 PolarHBondContact O-N 3.27Å; A386-N388 PolarHBondContact O-N 3.34Å; A386-L389 HydrophobicContact CB-CD2 4.42Å | ||
| 387 | D | 64.8 | Low | 79.6 | Confident | 150 Ų | 150 | 70.2 Ų | 70.2 | 80% | 0.802 | 39% | 0.388 | S | S | * | . | S | Bend | trans | -59.1 | 139.5 | 171.2 | -45.5 | -76.7 | 0 | 0 | 0 | 108.7 | ||
| 388 | N | 73.3 | Confident | 79.8 | Confident | 80 Ų | 80 | 67.3 Ų | 67.3 | 43% | 0.428 | 38% | 0.375 | S | S | . | . | trans | 72.7 | 50.4 | -177.6 | -38.6 | -101.8 | 0 | 0 | 0 | 116 | A386 D390 K391 | A386-N388 PolarHBondContact O-N 3.34Å; N388-D390 VanDerWaalsContact C-N 3.27Å; N388-D390 WeakPolarHBondContact CA-OD1 3.4Å; N388-D390 WeakPolarHBondContact CB-OD1 3.46Å; N388-K391 HydrophobicContact CB-CB 4.31Å; N388-K391 HydrophobicContact CB-CD 3.94Å; N388-K391 HydrophobicContact CB-CG 4.48Å; N388-K391 PolarHBondContact O-N 3.49Å; N388-K391 WeakPolarHBondContact OD1-CE 3.47Å; N388-K391 PolarHBondContact OD1-NZ 3.22Å | ||
| 389 | L | 81.6 | Confident | 80.1 | Confident | 14 Ų | 14 | 65 Ų | 65 | 7% | 0.073 | 36% | 0.364 | C | S | . | . | S | Bend | trans | -66.1 | -28 | 169.8 | -73.4 | 177.2 | 0 | 0 | 0 | 113.3 | I369 L384 A386 K391 V392 L400 L419 M420 | I369-L389 HydrophobicContact CG2-CD2 4.49Å; L384-L389 HydrophobicContact CD2-CD1 4.4Å; L384-L389 HydrophobicContact CD2-CD2 4.05Å; L384-L389 HydrophobicContact CG-CD2 4.26Å; A386-L389 HydrophobicContact CB-CD2 4.42Å; L389-K391 VanDerWaalsContact C-N 3.27Å; L389-K391 PolarHBondContact O-N 2.83Å; L389-V392 WeakPolarHBondContact O-CB 3.47Å; L389-V392 PolarHBondContact O-N 3.14Å; L389-L400 HydrophobicContact CB-CD1 4.3Å; L389-L400 HydrophobicContact CD2-CD1 3.89Å; L389-L419 HydrophobicContact CD1-CB 4.28Å; L389-M420 HydrophobicContact CB-CG 3.89Å; L389-M420 HydrophobicContact CB-SD 4.44Å |
| 390 | D | 81.8 | Confident | 80.4 | Confident | 58 Ų | 58 | 60.5 Ų | 60.5 | 31% | 0.31 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.4 | -45.3 | 170.6 | 61.6 | -36.5 | 0 | 0 | 0 | 111.8 | N388 V392 H393 | N388-D390 VanDerWaalsContact C-N 3.27Å; N388-D390 WeakPolarHBondContact CA-OD1 3.4Å; N388-D390 WeakPolarHBondContact CB-OD1 3.46Å; D390-V392 PolarHBondContact O-N 3.2Å; D390-H393 PolarHBondContact O-CE1 3.45Å; D390-H393 PolarHBondContact O-NE2 2.89Å |
| 391 | K | 83.1 | Confident | 81 | Confident | 117 Ų | 117 | 57.4 Ų | 57.4 | 51% | 0.509 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | 6.5 | -176.2 | -67.6 | 162.5 | -139 | 176.2 | 0 | 113.9 | N388 L389 H393 | N388-K391 HydrophobicContact CB-CB 4.31Å; N388-K391 HydrophobicContact CB-CD 3.94Å; N388-K391 HydrophobicContact CB-CG 4.48Å; N388-K391 PolarHBondContact O-N 3.49Å; N388-K391 WeakPolarHBondContact OD1-CE 3.47Å; N388-K391 PolarHBondContact OD1-NZ 3.22Å; L389-K391 VanDerWaalsContact C-N 3.27Å; L389-K391 PolarHBondContact O-N 2.83Å; K391-H393 PolarHBondContact O-CD2 2.94Å; K391-H393 PolarHBondContact O-N 3.39Å |
| 392 | V | 87.2 | Confident | 81.7 | Confident | 5 Ų | 5 | 57.3 Ų | 57.3 | 3% | 0.03 | 32% | 0.315 | C | S | . | . | trans | -95 | 92.1 | 180 | -173.4 | 0 | 0 | 0 | 0 | 110 | V366 I369 L370 L389 D390 L400 | V366-V392 HydrophobicContact CG1-CG1 4.14Å; I369-V392 HydrophobicContact CG2-CG1 4.06Å; L370-V392 HydrophobicContact CD2-CG1 4.09Å; L370-V392 HydrophobicContact CG-CG1 4.14Å; L389-V392 WeakPolarHBondContact O-CB 3.47Å; L389-V392 PolarHBondContact O-N 3.14Å; D390-V392 PolarHBondContact O-N 3.2Å; V392-L400 HydrophobicContact CB-CD1 4.29Å; V392-L400 HydrophobicContact CB-CD2 4.2Å; V392-L400 HydrophobicContact CB-CG 4.19Å; V392-L400 HydrophobicContact CG1-CD2 3.78Å; V392-L400 HydrophobicContact CG1-CG 4.32Å | ||
| 393 | H | 89.3 | Confident | 82.7 | Confident | 84 Ų | 84 | 52.7 Ų | 52.7 | 39% | 0.389 | 29% | 0.285 | S | S | . | . | trans | -109 | 157.7 | 176.6 | -42.9 | -77.6 | 0 | 0 | 0 | 112.1 | D390 K391 N398 E427 | D390-H393 PolarHBondContact O-CE1 3.45Å; D390-H393 PolarHBondContact O-NE2 2.89Å; K391-H393 PolarHBondContact O-CD2 2.94Å; K391-H393 PolarHBondContact O-N 3.39Å; H393-N398 CarbonylContact C-O 3.52Å; H393-N398 WeakPolarHBondContact CA-O 3.35Å; H393-E427 IonicContact CE1-OE2 2.66Å | ||
| 394 | D | 89.9 | Confident | 84.1 | Confident | 25 Ų | 25 | 45.2 Ų | 45.2 | 13% | 0.134 | 25% | 0.25 | C | S | . | . | trans | -93.1 | -176.1 | 167.6 | 80 | 4.5 | 0 | 0 | 0 | 113.8 | L370 K374 N396 G397 N398 I403 | L370-D394 HydrophobicContact CD1-CB 4.38Å; L370-D394 HydrophobicContact CD2-CB 4.18Å; K374-D394 IonicContact NZ-OD2 2.72Å; K374-D394 PolarHBondContact NZ-OD2 3.5Å; D394-N396 PolarHBondContact O-N 2.97Å; D394-N396 VanDerWaalsContact O-N 3.09Å; D394-N396 WeakPolarHBondContact OD1-CB 3.31Å; D394-N396 PolarHBondContact OD1-N 3.29Å; D394-G397 PolarHBondContact O-N 2.65Å; D394-N398 PolarHBondContact N-O 2.59Å; D394-N398 VanDerWaalsContact OD1-CB 3.3Å; D394-N398 WeakPolarHBondContact OD1-CB 3.33Å; D394-N398 PolarHBondContact OD1-N 2.96Å; D394-N398 PolarHBondContact OD1-ND2 3.3Å; D394-N398 PolarHBondContact OD2-ND2 2.87Å; D394-I403 HydrophobicContact CB-CD1 4.16Å | ||
| 395 | E | 90 | Very high | 85.3 | Confident | 166 Ų | 166 | 44.9 Ų | 44.9 | 78% | 0.776 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.7 | -8.4 | -175.2 | -62.9 | 170.3 | -166.8 | 0 | 0 | 113 | K367 | K367-E395 IonicContact NZ-OE1 3.94Å; K367-E395 PolarHBondContact NZ-OE1 2.9Å |
| 396 | N | 90.8 | Very high | 87.1 | Confident | 86 Ų | 86 | 41.2 Ų | 41.2 | 46% | 0.46 | 22% | 0.218 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -107.6 | 12.9 | 172.8 | -61.8 | 104.6 | 0 | 0 | 0 | 112.8 | D394 N398 T430 | D394-N396 PolarHBondContact O-N 2.97Å; D394-N396 VanDerWaalsContact O-N 3.09Å; D394-N396 WeakPolarHBondContact OD1-CB 3.31Å; D394-N396 PolarHBondContact OD1-N 3.29Å; N396-N398 PolarHBondContact O-N 2.79Å; N396-T430 WeakPolarHBondContact O-CG2 3.31Å; N396-T430 PolarHBondContact O-N 2.68Å; N396-T430 VanDerWaalsContact O-N 3.1Å; N396-T430 PolarHBondContact O-OG1 3.29Å |
| 397 | G | 90.9 | Very high | 88.6 | Confident | 29 Ų | 29 | 44.5 Ų | 44.5 | 30% | 0.299 | 23% | 0.23 | S | C | . | . | trans | 66.8 | 15.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114 | D394 N399 | D394-G397 PolarHBondContact O-N 2.65Å; G397-N399 PolarHBondContact O-N 3.12Å | ||
| 398 | N | 92.3 | Very high | 90 | Very high | 15 Ų | 15 | 38.6 Ų | 38.6 | 8% | 0.08 | 20% | 0.204 | C | C | . | . | trans | -72.6 | 122.3 | 173.4 | -60.4 | -51 | 0 | 0 | 0 | 108.9 | H393 D394 N396 H402 I403 N429 L438 | H393-N398 CarbonylContact C-O 3.52Å; H393-N398 WeakPolarHBondContact CA-O 3.35Å; D394-N398 PolarHBondContact N-O 2.59Å; D394-N398 VanDerWaalsContact OD1-CB 3.3Å; D394-N398 WeakPolarHBondContact OD1-CB 3.33Å; D394-N398 PolarHBondContact OD1-N 2.96Å; D394-N398 PolarHBondContact OD1-ND2 3.3Å; D394-N398 PolarHBondContact OD2-ND2 2.87Å; N396-N398 PolarHBondContact O-N 2.79Å; N398-H402 HydrophobicContact CB-CB 3.61Å; N398-I403 HydrophobicContact CB-CD1 4.39Å; N398-I403 HydrophobicContact CB-CG1 3.83Å; N398-N429 WeakPolarHBondContact OD1-CB 3.46Å; N398-N429 PolarHBondContact OD1-ND2 2.71Å; N398-L438 WeakPolarHBondContact OD1-CD2 3.3Å | ||
| 399 | N | 92.5 | Very high | 91 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.195 | C | C | . | . | trans | -69.6 | 177 | 164.3 | 73.7 | 20.8 | 0 | 0 | 0 | 111.1 | G397 L401 H402 I403 M420 C424 E427 | G397-N399 PolarHBondContact O-N 3.12Å; N399-L401 VanDerWaalsContact C-N 3.26Å; N399-L401 PolarHBondContact O-N 3.23Å; N399-L401 WeakPolarHBondContact OD1-CA 3.48Å; N399-L401 WeakPolarHBondContact OD1-CB 3.31Å; N399-L401 PolarHBondContact OD1-N 3.33Å; N399-H402 WeakPolarHBondContact CB-CE1 3.44Å; N399-H402 PolarHBondContact N-CE1 3.21Å; N399-H402 PolarHBondContact N-ND1 3.08Å; N399-H402 PolarHBondContact ND2-CE1 3.41Å; N399-H402 PolarHBondContact ND2-ND1 3.05Å; N399-H402 PolarHBondContact ND2-NE2 3.03Å; N399-H402 WeakPolarHBondContact O-CB 3.34Å; N399-H402 PolarHBondContact O-N 3.42Å; N399-H402 CovalentContact OD1-CE1 1.87Å; N399-H402 PolarHBondContact OD1-CE1 3.45Å; N399-H402 PolarHBondContact OD1-N 2.68Å; N399-H402 PolarHBondContact OD1-ND1 3.11Å; N399-I403 WeakPolarHBondContact O-CG1 3.27Å; N399-I403 PolarHBondContact O-N 3.48Å; N399-I403 VanDerWaalsContact O-N 3.16Å; N399-M420 HydrophobicContact CB-CE 4.43Å; N399-C424 PolarHBondContact ND2-O 2.95Å; N399-E427 VanDerWaalsContact ND2-CD 3.33Å; N399-E427 PolarHBondContact ND2-OE2 2.91Å | ||
| 400 | L | 91.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.1 | -30.3 | -178.7 | -56.5 | -178.6 | 0 | 0 | 0 | 113.8 | I369 L370 V373 L384 L389 V392 I403 A404 L416 M420 | I369-L400 HydrophobicContact CG2-CD1 3.9Å; I369-L400 HydrophobicContact CG2-CD2 3.99Å; L370-L400 HydrophobicContact CD2-CD2 3.76Å; V373-L400 WeakPolarHBondContact CG1-O 3.46Å; V373-L400 HydrophobicContact CG2-CD2 4.26Å; L384-L400 HydrophobicContact CD2-CD1 4.33Å; L389-L400 HydrophobicContact CB-CD1 4.3Å; L389-L400 HydrophobicContact CD2-CD1 3.89Å; V392-L400 HydrophobicContact CB-CD1 4.29Å; V392-L400 HydrophobicContact CB-CD2 4.2Å; V392-L400 HydrophobicContact CB-CG 4.19Å; V392-L400 HydrophobicContact CG1-CD2 3.78Å; V392-L400 HydrophobicContact CG1-CG 4.32Å; L400-I403 PolarHBondContact O-N 2.99Å; L400-A404 PolarHBondContact O-N 3.43Å; L400-L416 HydrophobicContact CB-CD1 4.13Å; L400-L416 HydrophobicContact CB-CD2 4.31Å; L400-L416 HydrophobicContact CD1-CD2 4.15Å; L400-M420 HydrophobicContact CB-CE 4.21Å; L400-M420 HydrophobicContact CB-SD 3.82Å; L400-M420 HydrophobicContact CD1-SD 4.2Å; L400-M420 HydrophobicContact CG-SD 4.36Å |
| 401 | L | 93.7 | Very high | 92.1 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -69.9 | -46.1 | 177.2 | -52.7 | -175.1 | 0 | 0 | 0 | 111.1 | N399 I403 A404 A405 L413 L416 M420 C424 L425 P435 | N399-L401 VanDerWaalsContact C-N 3.26Å; N399-L401 PolarHBondContact O-N 3.23Å; N399-L401 WeakPolarHBondContact OD1-CA 3.48Å; N399-L401 WeakPolarHBondContact OD1-CB 3.31Å; N399-L401 PolarHBondContact OD1-N 3.33Å; L401-I403 PolarHBondContact O-N 3.32Å; L401-A404 PolarHBondContact O-N 2.95Å; L401-A405 WeakPolarHBondContact O-CB 3.38Å; L401-A405 PolarHBondContact O-N 3.01Å; L401-L413 HydrophobicContact CB-CD1 3.85Å; L401-L413 HydrophobicContact CD2-CD1 4.09Å; L401-L413 WeakPolarHBondContact O-CD1 3.31Å; L401-L416 HydrophobicContact CD2-CB 3.36Å; L401-M420 HydrophobicContact CD2-SD 3.88Å; L401-M420 HydrophobicContact CG-CE 4.26Å; L401-M420 HydrophobicContact CG-SD 4.02Å; L401-C424 HydrophobicContact CD1-CB 3.56Å; L401-C424 HydrophobicContact CG-CB 4.39Å; L401-L425 HydrophobicContact CB-CD2 4.22Å; L401-L425 HydrophobicContact CD1-CD2 3.65Å; L401-L425 HydrophobicContact CD1-CG 3.9Å; L401-L425 HydrophobicContact CG-CD2 4.5Å; L401-P435 HydrophobicContact CB-CB 4.33Å; L401-P435 HydrophobicContact CB-CG 3.97Å |
| 402 | H | 94.1 | Very high | 92.5 | Very high | 1 Ų | 1 | 35.2 Ų | 35.2 | 1% | 0.005 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -51.7 | -45.2 | 171.4 | -73.7 | 86 | 0 | 0 | 0 | 111.1 | N398 N399 S406 E427 P435 L438 | N398-H402 HydrophobicContact CB-CB 3.61Å; N399-H402 WeakPolarHBondContact CB-CE1 3.44Å; N399-H402 PolarHBondContact N-CE1 3.21Å; N399-H402 PolarHBondContact N-ND1 3.08Å; N399-H402 PolarHBondContact ND2-CE1 3.41Å; N399-H402 PolarHBondContact ND2-ND1 3.05Å; N399-H402 PolarHBondContact ND2-NE2 3.03Å; N399-H402 WeakPolarHBondContact O-CB 3.34Å; N399-H402 PolarHBondContact O-N 3.42Å; N399-H402 CovalentContact OD1-CE1 1.87Å; N399-H402 PolarHBondContact OD1-CE1 3.45Å; N399-H402 PolarHBondContact OD1-N 2.68Å; N399-H402 PolarHBondContact OD1-ND1 3.11Å; H402-S406 VanDerWaalsContact O-CB 3.23Å; H402-S406 WeakPolarHBondContact O-CB 3.43Å; H402-S406 PolarHBondContact O-N 3.49Å; H402-S406 PolarHBondContact O-OG 3.25Å; H402-E427 WeakPolarHBondContact NE2-CB 3.42Å; H402-E427 PolarHBondContact NE2-O 3.36Å; H402-P435 HydrophobicContact CB-CG 4.42Å; H402-L438 HydrophobicContact CB-CD2 3.91Å |
| 403 | I | 93.6 | Very high | 92.8 | Very high | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.005 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -65.8 | -51.6 | -178.9 | -66 | 168.9 | 0 | 0 | 0 | 111.1 | L370 V373 K374 D394 N398 N399 L400 L401 A405 S406 Q407 | L370-I403 HydrophobicContact CD2-CD1 3.31Å; V373-I403 HydrophobicContact CB-CG2 4.38Å; V373-I403 HydrophobicContact CG1-CB 4.17Å; V373-I403 HydrophobicContact CG1-CG2 3.86Å; K374-I403 HydrophobicContact CB-CG2 4.37Å; K374-I403 HydrophobicContact CD-CG2 4.24Å; K374-I403 HydrophobicContact CG-CG2 3.33Å; D394-I403 HydrophobicContact CB-CD1 4.16Å; N398-I403 HydrophobicContact CB-CD1 4.39Å; N398-I403 HydrophobicContact CB-CG1 3.83Å; N399-I403 WeakPolarHBondContact O-CG1 3.27Å; N399-I403 PolarHBondContact O-N 3.48Å; N399-I403 VanDerWaalsContact O-N 3.16Å; L400-I403 PolarHBondContact O-N 2.99Å; L401-I403 PolarHBondContact O-N 3.32Å; I403-A405 VanDerWaalsContact C-N 3.31Å; I403-A405 PolarHBondContact O-N 3.36Å; I403-S406 PolarHBondContact O-N 3.45Å; I403-S406 PolarHBondContact O-OG 2.84Å; I403-Q407 WeakPolarHBondContact O-CG 3.41Å; I403-Q407 PolarHBondContact O-N 2.97Å |
| 404 | A | 94.5 | Very high | 92.9 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -58.9 | -42.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | V373 L400 L401 Q407 G408 H409 C412 L413 L416 | V373-A404 HydrophobicContact CG1-CB 3.89Å; L400-A404 PolarHBondContact O-N 3.43Å; L401-A404 PolarHBondContact O-N 2.95Å; A404-Q407 PolarHBondContact O-N 3.45Å; A404-G408 PolarHBondContact O-N 3.27Å; A404-G408 VanDerWaalsContact O-N 3.17Å; A404-H409 PolarHBondContact O-N 2.69Å; A404-H409 VanDerWaalsContact O-N 3.08Å; A404-C412 HydrophobicContact CB-CB 4.44Å; A404-L413 HydrophobicContact CB-CB 4.06Å; A404-L413 HydrophobicContact CB-CD1 4.23Å; A404-L416 HydrophobicContact CB-CD1 4.01Å |
| 405 | A | 95.4 | Very high | 93 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65 | -41.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L401 I403 Q407 G408 L413 P435 A439 Q444 M451 | L401-A405 WeakPolarHBondContact O-CB 3.38Å; L401-A405 PolarHBondContact O-N 3.01Å; I403-A405 VanDerWaalsContact C-N 3.31Å; I403-A405 PolarHBondContact O-N 3.36Å; A405-Q407 VanDerWaalsContact C-N 3.3Å; A405-Q407 PolarHBondContact O-N 2.9Å; A405-G408 PolarHBondContact O-N 2.88Å; A405-L413 HydrophobicContact CB-CD1 4.16Å; A405-L413 HydrophobicContact CB-CD2 4.15Å; A405-P435 HydrophobicContact CB-CB 3.94Å; A405-P435 WeakPolarHBondContact CB-O 3.23Å; A405-A439 HydrophobicContact CB-CB 4.07Å; A405-Q444 WeakPolarHBondContact O-CB 3.28Å; A405-Q444 WeakPolarHBondContact O-CG 3.31Å; A405-M451 HydrophobicContact CB-CE 4.09Å |
| 406 | S | 94.9 | Very high | 93 | Very high | 15 Ų | 15 | 29.9 Ų | 29.9 | 11% | 0.105 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.5 | -30.8 | 176.5 | 76.2 | 0 | 0 | 0 | 0 | 113.6 | H402 I403 N442 Q444 | H402-S406 VanDerWaalsContact O-CB 3.23Å; H402-S406 WeakPolarHBondContact O-CB 3.43Å; H402-S406 PolarHBondContact O-N 3.49Å; H402-S406 PolarHBondContact O-OG 3.25Å; I403-S406 PolarHBondContact O-N 3.45Å; I403-S406 PolarHBondContact O-OG 2.84Å; S406-N442 WeakPolarHBondContact CB-ND2 3.28Å; S406-N442 WeakPolarHBondContact O-CB 3.47Å; S406-N442 PolarHBondContact O-ND2 3.19Å; S406-Q444 WeakPolarHBondContact O-CG 3.49Å; S406-Q444 PolarHBondContact O-NE2 2.87Å |
| 407 | Q | 94.4 | Very high | 93 | Very high | 89 Ų | 89 | 26.3 Ų | 26.3 | 42% | 0.416 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -91.9 | -10 | -177.5 | -65.3 | -74.6 | 90.4 | 0 | 0 | 113.3 | K374 I403 A404 A405 H409 Q444 | K374-Q407 PolarHBondContact O-NE2 3.47Å; I403-Q407 WeakPolarHBondContact O-CG 3.41Å; I403-Q407 PolarHBondContact O-N 2.97Å; A404-Q407 PolarHBondContact O-N 3.45Å; A405-Q407 VanDerWaalsContact C-N 3.3Å; A405-Q407 PolarHBondContact O-N 2.9Å; Q407-H409 WeakPolarHBondContact CB-CD2 3.41Å; Q407-Q444 PolarHBondContact O-NE2 3.32Å |
| 408 | G | 94.1 | Very high | 92.9 | Very high | 25 Ų | 25 | 29.7 Ų | 29.7 | 26% | 0.258 | 16% | 0.163 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 85 | 11 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | A404 A405 A410 | A404-G408 PolarHBondContact O-N 3.27Å; A404-G408 VanDerWaalsContact O-N 3.17Å; A405-G408 PolarHBondContact O-N 2.88Å; G408-A410 VanDerWaalsContact C-N 3.3Å; G408-A410 PolarHBondContact O-N 3.28Å |
| 409 | H | 95.2 | Very high | 92.7 | Very high | 54 Ų | 54 | 33.7 Ų | 33.7 | 25% | 0.25 | 18% | 0.184 | C | C | . | . | trans | -81.6 | 70 | -175.1 | -59.4 | -50.4 | 0 | 0 | 0 | 111.3 | V373 K374 G376 A404 Q407 E411 C412 L413 | V373-H409 PolarHBondContact O-CD2 2.87Å; K374-H409 PolarHBondContact O-NE2 3.07Å; G376-H409 WeakPolarHBondContact CA-CD2 3.43Å; G376-H409 WeakPolarHBondContact CA-NE2 3.33Å; G376-H409 PolarHBondContact N-CD2 3.46Å; G376-H409 PolarHBondContact N-NE2 3.07Å; A404-H409 PolarHBondContact O-N 2.69Å; A404-H409 VanDerWaalsContact O-N 3.08Å; Q407-H409 WeakPolarHBondContact CB-CD2 3.41Å; H409-E411 PolarHBondContact O-N 2.88Å; H409-C412 HydrophobicContact CB-CB 3.55Å; H409-C412 WeakPolarHBondContact O-CA 3.48Å; H409-C412 VanDerWaalsContact O-CB 3.28Å; H409-C412 WeakPolarHBondContact O-CB 3.41Å; H409-C412 PolarHBondContact O-N 3.07Å; H409-L413 PolarHBondContact O-N 3.26Å | ||
| 410 | A | 93.8 | Very high | 92.4 | Very high | 21 Ų | 21 | 35 Ų | 35 | 17% | 0.174 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -56.8 | -41.1 | -173 | 0 | 0 | 0 | 0 | 0 | 114.3 | G408 L413 Q414 E446 | G408-A410 VanDerWaalsContact C-N 3.3Å; G408-A410 PolarHBondContact O-N 3.28Å; A410-L413 WeakPolarHBondContact O-CB 3.28Å; A410-L413 PolarHBondContact O-N 3.49Å; A410-Q414 WeakPolarHBondContact O-CG 3.38Å; A410-Q414 PolarHBondContact O-N 3.33Å; A410-E446 HydrophobicContact CB-CB 4.26Å |
| 411 | E | 92.6 | Very high | 92.1 | Very high | 123 Ų | 123 | 36.5 Ų | 36.5 | 58% | 0.575 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -66.1 | -36.7 | 174.2 | -67.9 | 175.5 | -164.5 | 0 | 0 | 112.1 | I378 H409 H415 | I378-E411 HydrophobicContact CD1-CB 3.56Å; I378-E411 HydrophobicContact CG1-CB 4.35Å; H409-E411 PolarHBondContact O-N 2.88Å; E411-H415 PolarHBondContact O-CD2 3.43Å; E411-H415 PolarHBondContact O-N 2.93Å; E411-H415 VanDerWaalsContact O-N 3.08Å |
| 412 | C | 92 | Very high | 91.8 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -66.4 | -41 | 174.6 | -175.8 | 0 | 0 | 0 | 0 | 111.2 | I378 L381 A404 H409 H415 L416 | I378-C412 HydrophobicContact CG1-CB 3.92Å; L381-C412 HydrophobicContact CD1-CB 4.21Å; A404-C412 HydrophobicContact CB-CB 4.44Å; H409-C412 HydrophobicContact CB-CB 3.55Å; H409-C412 WeakPolarHBondContact O-CA 3.48Å; H409-C412 VanDerWaalsContact O-CB 3.28Å; H409-C412 WeakPolarHBondContact O-CB 3.41Å; H409-C412 PolarHBondContact O-N 3.07Å; C412-H415 PolarHBondContact O-N 2.98Å; C412-L416 WeakPolarHBondContact O-CB 3.4Å; C412-L416 WeakPolarHBondContact O-CD1 3.36Å; C412-L416 VanDerWaalsContact O-CG 3.25Å; C412-L416 WeakPolarHBondContact O-CG 3.22Å; C412-L416 PolarHBondContact O-N 3.37Å |
| 413 | L | 93.1 | Very high | 91.4 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.7 | -50.6 | 176.6 | -178.5 | 65.7 | 0 | 0 | 0 | 110.8 | L401 A404 A405 H409 A410 H415 L416 T417 C447 W450 M451 | L401-L413 HydrophobicContact CB-CD1 3.85Å; L401-L413 HydrophobicContact CD2-CD1 4.09Å; L401-L413 WeakPolarHBondContact O-CD1 3.31Å; A404-L413 HydrophobicContact CB-CB 4.06Å; A404-L413 HydrophobicContact CB-CD1 4.23Å; A405-L413 HydrophobicContact CB-CD1 4.16Å; A405-L413 HydrophobicContact CB-CD2 4.15Å; H409-L413 PolarHBondContact O-N 3.26Å; A410-L413 WeakPolarHBondContact O-CB 3.28Å; A410-L413 PolarHBondContact O-N 3.49Å; L413-H415 PolarHBondContact O-N 2.96Å; L413-L416 PolarHBondContact O-N 3.02Å; L413-L416 VanDerWaalsContact O-N 3.16Å; L413-T417 PolarHBondContact O-N 2.88Å; L413-T417 PolarHBondContact O-OG1 3.27Å; L413-C447 HydrophobicContact CD2-CB 3.9Å; L413-W450 HydrophobicContact CD2-CE3 3.92Å; L413-W450 HydrophobicContact CD2-CZ3 4.11Å; L413-W450 HydrophobicContact CG-CE3 4.11Å; L413-W450 HydrophobicContact CG-CZ3 3.88Å; L413-M451 HydrophobicContact CD2-CE 3.92Å; L413-M451 HydrophobicContact CD2-CG 4.01Å; L413-M451 HydrophobicContact CD2-SD 3.97Å |
| 414 | Q | 92.1 | Very high | 91.1 | Very high | 75 Ų | 75 | 47.9 Ų | 47.9 | 35% | 0.35 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -53.5 | -49.4 | 174.8 | -76.9 | 167.1 | 0.2 | 0 | 0 | 112.5 | A410 L416 S418 W450 | A410-Q414 WeakPolarHBondContact O-CG 3.38Å; A410-Q414 PolarHBondContact O-N 3.33Å; Q414-L416 PolarHBondContact O-N 3.39Å; Q414-S418 PolarHBondContact O-N 3.16Å; Q414-S418 VanDerWaalsContact O-N 3.15Å; Q414-W450 HydrophobicContact CB-CZ2 4.5Å; Q414-W450 HydrophobicContact CG-CD2 3.59Å; Q414-W450 VanDerWaalsContact CG-CE2 3.44Å; Q414-W450 HydrophobicContact CG-CE3 4.1Å; Q414-W450 HydrophobicContact CG-CG 4Å; Q414-W450 HydrophobicContact CG-CH2 4.32Å; Q414-W450 HydrophobicContact CG-CZ2 3.84Å; Q414-W450 HydrophobicContact CG-CZ3 4.44Å |
| 415 | H | 90.4 | Very high | 90.8 | Very high | 94 Ų | 94 | 48.1 Ų | 48.1 | 44% | 0.435 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -67.3 | -33.7 | 179 | -75.5 | -52.1 | 0 | 0 | 0 | 113.2 | L381 E411 C412 L413 L419 | L381-H415 HydrophobicContact CD1-CB 3.86Å; E411-H415 PolarHBondContact O-CD2 3.43Å; E411-H415 PolarHBondContact O-N 2.93Å; E411-H415 VanDerWaalsContact O-N 3.08Å; C412-H415 PolarHBondContact O-N 2.98Å; L413-H415 PolarHBondContact O-N 2.96Å; H415-L419 WeakPolarHBondContact O-CG 3.46Å; H415-L419 PolarHBondContact O-N 2.89Å |
| 416 | L | 89.8 | Confident | 90.5 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -73.1 | -41.5 | 175.9 | -74.5 | 165.4 | 0 | 0 | 0 | 112.4 | V373 L381 L384 L400 L401 A404 C412 L413 Q414 S418 L419 M420 | V373-L416 HydrophobicContact CB-CD1 4.48Å; V373-L416 HydrophobicContact CG1-CD1 3.68Å; V373-L416 HydrophobicContact CG2-CD1 3.9Å; V373-L416 HydrophobicContact CG2-CD2 4.37Å; L381-L416 HydrophobicContact CD1-CG 4.49Å; L381-L416 HydrophobicContact CD2-CD2 4.09Å; L381-L416 HydrophobicContact CD2-CG 4.3Å; L384-L416 HydrophobicContact CD2-CD2 3.94Å; L400-L416 HydrophobicContact CB-CD1 4.13Å; L400-L416 HydrophobicContact CB-CD2 4.31Å; L400-L416 HydrophobicContact CD1-CD2 4.15Å; L401-L416 HydrophobicContact CD2-CB 3.36Å; A404-L416 HydrophobicContact CB-CD1 4.01Å; C412-L416 WeakPolarHBondContact O-CB 3.4Å; C412-L416 WeakPolarHBondContact O-CD1 3.36Å; C412-L416 VanDerWaalsContact O-CG 3.25Å; C412-L416 WeakPolarHBondContact O-CG 3.22Å; C412-L416 PolarHBondContact O-N 3.37Å; L413-L416 PolarHBondContact O-N 3.02Å; L413-L416 VanDerWaalsContact O-N 3.16Å; Q414-L416 PolarHBondContact O-N 3.39Å; L416-S418 VanDerWaalsContact C-N 3.26Å; L416-S418 PolarHBondContact O-N 2.96Å; L416-L419 CarbonylContact O-C 3.56Å; L416-L419 WeakPolarHBondContact O-CA 3.48Å; L416-L419 PolarHBondContact O-N 3.01Å; L416-M420 HydrophobicContact CB-SD 4.32Å; L416-M420 HydrophobicContact CD2-SD 4.4Å; L416-M420 WeakPolarHBondContact O-CB 3.38Å; L416-M420 WeakPolarHBondContact O-CG 3.47Å; L416-M420 PolarHBondContact O-N 3.07Å |
| 417 | T | 91 | Very high | 90.3 | Very high | 10 Ų | 10 | 54.2 Ų | 54.2 | 6% | 0.061 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.9 | -39.5 | 174.4 | -58.9 | 0 | 0 | 0 | 0 | 110.7 | L413 L419 M420 G421 E422 L425 W450 | L413-T417 PolarHBondContact O-N 2.88Å; L413-T417 PolarHBondContact O-OG1 3.27Å; T417-L419 PolarHBondContact O-N 3.4Å; T417-L419 VanDerWaalsContact O-N 3.13Å; T417-M420 PolarHBondContact O-N 3.07Å; T417-G421 WeakPolarHBondContact O-CA 3.44Å; T417-G421 PolarHBondContact O-N 3.06Å; T417-E422 HydrophobicContact CG2-CB 4.47Å; T417-E422 HydrophobicContact CG2-CG 3.68Å; T417-L425 HydrophobicContact CG2-CD1 4.04Å; T417-W450 HydrophobicContact CG2-CH2 4.04Å |
| 418 | S | 89.4 | Confident | 90.1 | Very high | 101 Ų | 101 | 53.5 Ų | 53.5 | 71% | 0.706 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -65.2 | -10.6 | 173 | -175.6 | 0 | 0 | 0 | 0 | 114.9 | Q414 L416 | Q414-S418 PolarHBondContact O-N 3.16Å; Q414-S418 VanDerWaalsContact O-N 3.15Å; L416-S418 VanDerWaalsContact C-N 3.26Å; L416-S418 PolarHBondContact O-N 2.96Å |
| 419 | L | 87.4 | Confident | 90 | Very high | 99 Ų | 99 | 52.8 Ų | 52.8 | 52% | 0.518 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -110.5 | -25.6 | 178.1 | -69.7 | 171 | 0 | 0 | 0 | 113.3 | L389 H415 L416 T417 | L389-L419 HydrophobicContact CD1-CB 4.28Å; H415-L419 WeakPolarHBondContact O-CG 3.46Å; H415-L419 PolarHBondContact O-N 2.89Å; L416-L419 CarbonylContact O-C 3.56Å; L416-L419 WeakPolarHBondContact O-CA 3.48Å; L416-L419 PolarHBondContact O-N 3.01Å; T417-L419 PolarHBondContact O-N 3.4Å; T417-L419 VanDerWaalsContact O-N 3.13Å |
| 420 | M | 86.8 | Confident | 89.9 | Confident | 28 Ų | 28 | 55 Ų | 55 | 14% | 0.138 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -104.1 | -21.9 | -176.1 | -64.7 | 173.2 | 66.8 | 0 | 0 | 113.2 | L389 N399 L400 L401 L416 T417 C424 | L389-M420 HydrophobicContact CB-CG 3.89Å; L389-M420 HydrophobicContact CB-SD 4.44Å; N399-M420 HydrophobicContact CB-CE 4.43Å; L400-M420 HydrophobicContact CB-CE 4.21Å; L400-M420 HydrophobicContact CB-SD 3.82Å; L400-M420 HydrophobicContact CD1-SD 4.2Å; L400-M420 HydrophobicContact CG-SD 4.36Å; L401-M420 HydrophobicContact CD2-SD 3.88Å; L401-M420 HydrophobicContact CG-CE 4.26Å; L401-M420 HydrophobicContact CG-SD 4.02Å; L416-M420 HydrophobicContact CB-SD 4.32Å; L416-M420 HydrophobicContact CD2-SD 4.4Å; L416-M420 WeakPolarHBondContact O-CB 3.38Å; L416-M420 WeakPolarHBondContact O-CG 3.47Å; L416-M420 PolarHBondContact O-N 3.07Å; T417-M420 PolarHBondContact O-N 3.07Å; M420-C424 HydrophobicContact CB-CB 4.45Å; M420-C424 HydrophobicContact CE-CB 4.22Å |
| 421 | G | 85.6 | Confident | 89.8 | Confident | 31 Ų | 31 | 58.3 Ų | 58.3 | 32% | 0.32 | 31% | 0.307 | S | S | . | . | trans | 92.8 | 164.3 | -168.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | T417 | T417-G421 WeakPolarHBondContact O-CA 3.44Å; T417-G421 PolarHBondContact O-N 3.06Å | ||
| 422 | E | 86.8 | Confident | 89.7 | Confident | 103 Ų | 103 | 58.8 Ų | 58.8 | 48% | 0.481 | 31% | 0.307 | S | S | . | . | S | Bend | trans | -78.9 | -23 | 179.6 | -71.8 | 176.6 | -126.6 | 0 | 0 | 112.7 | T417 C424 L425 | T417-E422 HydrophobicContact CG2-CB 4.47Å; T417-E422 HydrophobicContact CG2-CG 3.68Å; E422-C424 PolarHBondContact O-N 2.85Å; E422-C424 VanDerWaalsContact O-N 3.15Å; E422-L425 VanDerWaalsContact O-CB 3.26Å; E422-L425 WeakPolarHBondContact O-CB 3.35Å; E422-L425 PolarHBondContact O-N 2.94Å |
| 423 | D | 86.4 | Confident | 89.7 | Confident | 132 Ų | 132 | 59 Ų | 59 | 71% | 0.706 | 31% | 0.308 | S | S | * | . | G | 310 helix | trans | -54.7 | -35.9 | 177.7 | -63.3 | -60.8 | 0 | 0 | 0 | 112.6 | L425 N426 | D423-L425 PolarHBondContact O-N 3.07Å; D423-L425 VanDerWaalsContact O-N 3.12Å; D423-N426 WeakPolarHBondContact O-CB 3.49Å; D423-N426 PolarHBondContact O-N 3.01Å |
| 424 | C | 87.1 | Confident | 89.8 | Confident | 6 Ų | 6 | 59 Ų | 59 | 4% | 0.041 | 31% | 0.308 | C | S | . | . | G | 310 helix | trans | -66.6 | -8.9 | 177.4 | -65.7 | 0 | 0 | 0 | 0 | 113.9 | N399 L401 M420 E422 E427 | N399-C424 PolarHBondContact ND2-O 2.95Å; L401-C424 HydrophobicContact CD1-CB 3.56Å; L401-C424 HydrophobicContact CG-CB 4.39Å; M420-C424 HydrophobicContact CB-CB 4.45Å; M420-C424 HydrophobicContact CE-CB 4.22Å; E422-C424 PolarHBondContact O-N 2.85Å; E422-C424 VanDerWaalsContact O-N 3.15Å; C424-E427 WeakPolarHBondContact CA-OE1 3.22Å; C424-E427 PolarHBondContact SG-OE1 2.98Å |
| 425 | L | 89 | Confident | 89.8 | Confident | 4 Ų | 4 | 55.4 Ų | 55.4 | 2% | 0.021 | 29% | 0.292 | C | S | . | . | G | 310 helix | trans | -80.4 | -22.3 | 169.2 | -64 | 171.8 | 0 | 0 | 0 | 112.4 | L401 T417 E422 D423 P435 M451 T455 | L401-L425 HydrophobicContact CB-CD2 4.22Å; L401-L425 HydrophobicContact CD1-CD2 3.65Å; L401-L425 HydrophobicContact CD1-CG 3.9Å; L401-L425 HydrophobicContact CG-CD2 4.5Å; T417-L425 HydrophobicContact CG2-CD1 4.04Å; E422-L425 VanDerWaalsContact O-CB 3.26Å; E422-L425 WeakPolarHBondContact O-CB 3.35Å; E422-L425 PolarHBondContact O-N 2.94Å; D423-L425 PolarHBondContact O-N 3.07Å; D423-L425 VanDerWaalsContact O-N 3.12Å; L425-P435 HydrophobicContact CD2-CB 4.3Å; L425-P435 HydrophobicContact CD2-CG 4.3Å; L425-P435 VanDerWaalsContact O-CD 3.24Å; L425-P435 WeakPolarHBondContact O-CD 3.45Å; L425-M451 HydrophobicContact CD2-CG 4.26Å; L425-M451 HydrophobicContact CD2-SD 3.88Å; L425-T455 HydrophobicContact CD1-CG2 3.79Å |
| 426 | N | 89.2 | Confident | 90 | Very high | 81 Ų | 81 | 51 Ų | 51 | 43% | 0.433 | 27% | 0.271 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.8 | -13.5 | 178.1 | -65.1 | -48.6 | 0 | 0 | 0 | 112.9 | D423 | D423-N426 WeakPolarHBondContact O-CB 3.49Å; D423-N426 PolarHBondContact O-N 3.01Å |
| 427 | E | 89.6 | Confident | 90.2 | Very high | 63 Ų | 63 | 51 Ų | 51 | 29% | 0.294 | 27% | 0.271 | S | S | . | . | trans | -58.8 | 145.9 | 172.8 | -76 | 175.8 | -145.6 | 0 | 0 | 111.8 | H393 N399 H402 C424 T434 | H393-E427 IonicContact CE1-OE2 2.66Å; N399-E427 VanDerWaalsContact ND2-CD 3.33Å; N399-E427 PolarHBondContact ND2-OE2 2.91Å; H402-E427 WeakPolarHBondContact NE2-CB 3.42Å; H402-E427 PolarHBondContact NE2-O 3.36Å; C424-E427 WeakPolarHBondContact CA-OE1 3.22Å; C424-E427 PolarHBondContact SG-OE1 2.98Å; E427-T434 WeakPolarHBondContact O-CA 3.27Å | ||
| 428 | R | 90.7 | Very high | 90.3 | Very high | 74 Ų | 74 | 51 Ų | 51 | 28% | 0.279 | 27% | 0.271 | S | S | . | . | trans | -120.8 | 130.6 | 179.3 | -69.6 | 178.2 | -178.6 | -83 | -12.9 | 111.4 | K432 L433 T434 E460 | R428-K432 WeakPolarHBondContact CD-O 3.47Å; R428-K432 PolarHBondContact NH1-O 3.41Å; R428-L433 CarbonylContact C-O 3.6Å; R428-L433 VanDerWaalsContact CA-O 3.3Å; R428-L433 WeakPolarHBondContact CA-O 3.49Å; R428-T434 HydrophobicContact CG-CG2 3.7Å; R428-E460 IonicContact CZ-OE2 3.96Å; R428-E460 IonicContact NH1-OE2 2.62Å; R428-E460 IonicContact NH2-OE2 2.87Å; R428-E460 PolarHBondContact NH2-OE2 2.9Å | ||
| 429 | N | 92.4 | Very high | 90.6 | Very high | 10 Ų | 10 | 46.2 Ų | 46.2 | 5% | 0.053 | 24% | 0.237 | C | C | . | . | trans | -72.6 | -173.7 | 179.1 | 74.4 | 1.2 | 0 | 0 | 0 | 113.3 | N398 E431 K432 L433 | N398-N429 WeakPolarHBondContact OD1-CB 3.46Å; N398-N429 PolarHBondContact OD1-ND2 2.71Å; N429-E431 PolarHBondContact O-N 2.86Å; N429-E431 VanDerWaalsContact O-N 3.14Å; N429-E431 WeakPolarHBondContact OD1-CA 3.38Å; N429-E431 WeakPolarHBondContact OD1-CB 3.41Å; N429-E431 PolarHBondContact OD1-N 3.34Å; N429-K432 WeakPolarHBondContact O-CA 3.17Å; N429-K432 PolarHBondContact O-N 3.2Å; N429-K432 PolarHBondContact OD1-N 2.9Å; N429-L433 PolarHBondContact N-O 2.78Å; N429-L433 PolarHBondContact OD1-N 3.32Å; N429-L433 PolarHBondContact OD1-O 3.45Å | ||
| 430 | T | 93.6 | Very high | 91 | Very high | 100 Ų | 100 | 41.5 Ų | 41.5 | 61% | 0.613 | 21% | 0.213 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | -20.4 | 178.8 | 57.6 | 0 | 0 | 0 | 0 | 114.4 | N396 K432 | N396-T430 WeakPolarHBondContact O-CG2 3.31Å; N396-T430 PolarHBondContact O-N 2.68Å; N396-T430 VanDerWaalsContact O-N 3.1Å; N396-T430 PolarHBondContact O-OG1 3.29Å; T430-K432 VanDerWaalsContact C-N 3.29Å |
| 431 | E | 90.8 | Very high | 91.4 | Very high | 91 Ų | 91 | 43.2 Ų | 43.2 | 43% | 0.425 | 22% | 0.22 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.3 | 3.5 | 174 | -57.7 | -174 | 152.4 | 0 | 0 | 112.8 | N429 L433 K441 | N429-E431 PolarHBondContact O-N 2.86Å; N429-E431 VanDerWaalsContact O-N 3.14Å; N429-E431 WeakPolarHBondContact OD1-CA 3.38Å; N429-E431 WeakPolarHBondContact OD1-CB 3.41Å; N429-E431 PolarHBondContact OD1-N 3.34Å; E431-L433 HydrophobicContact CB-CD1 4.32Å; E431-L433 HydrophobicContact CB-CG 4.09Å; E431-L433 PolarHBondContact O-N 2.61Å; E431-L433 WeakPolarHBondContact OE2-CD1 3.5Å; E431-K441 IonicContact OE1-NZ 3.66Å; E431-K441 PolarHBondContact OE1-NZ 3.47Å; E431-K441 IonicContact OE2-NZ 3.12Å; E431-K441 PolarHBondContact OE2-NZ 3.06Å |
| 432 | K | 91.6 | Very high | 91.9 | Very high | 133 Ų | 133 | 45.2 Ų | 45.2 | 58% | 0.578 | 22% | 0.223 | S | C | * | . | S | Bend | trans | 64.9 | 15.6 | -172.9 | -57.6 | 174.5 | 167.7 | -166.7 | 0 | 114.7 | R428 N429 T430 F467 | R428-K432 WeakPolarHBondContact CD-O 3.47Å; R428-K432 PolarHBondContact NH1-O 3.41Å; N429-K432 WeakPolarHBondContact O-CA 3.17Å; N429-K432 PolarHBondContact O-N 3.2Å; N429-K432 PolarHBondContact OD1-N 2.9Å; T430-K432 VanDerWaalsContact C-N 3.29Å; K432-F467 HydrophobicContact CB-CD1 4.18Å; K432-F467 HydrophobicContact CB-CE1 3.89Å; K432-F467 HydrophobicContact CD-CE1 4.09Å; K432-F467 HydrophobicContact CG-CE1 4.25Å |
| 433 | L | 92.1 | Very high | 92.3 | Very high | 3 Ų | 3 | 41.7 Ų | 41.7 | 2% | 0.016 | 21% | 0.214 | C | C | . | . | trans | -88.5 | 142.2 | 176.1 | -58.3 | -178.7 | 0 | 0 | 0 | 110.4 | R428 N429 E431 L438 K441 Y473 | R428-L433 CarbonylContact C-O 3.6Å; R428-L433 VanDerWaalsContact CA-O 3.3Å; R428-L433 WeakPolarHBondContact CA-O 3.49Å; N429-L433 PolarHBondContact N-O 2.78Å; N429-L433 PolarHBondContact OD1-N 3.32Å; N429-L433 PolarHBondContact OD1-O 3.45Å; E431-L433 HydrophobicContact CB-CD1 4.32Å; E431-L433 HydrophobicContact CB-CG 4.09Å; E431-L433 PolarHBondContact O-N 2.61Å; E431-L433 WeakPolarHBondContact OE2-CD1 3.5Å; L433-L438 HydrophobicContact CB-CB 4.42Å; L433-L438 HydrophobicContact CD1-CD1 4.23Å; L433-K441 HydrophobicContact CD1-CB 4.41Å; L433-K441 HydrophobicContact CD1-CD 3.88Å; L433-Y473 HydrophobicContact CD2-CD1 3.85Å; L433-Y473 HydrophobicContact CD2-CE1 3.25Å; L433-Y473 HydrophobicContact CD2-CE2 4.42Å | ||
| 434 | T | 93.3 | Very high | 92.7 | Very high | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.006 | 19% | 0.192 | C | C | . | . | trans | -77.7 | 172 | 163.5 | 53.4 | 0 | 0 | 0 | 0 | 110.9 | E427 R428 A436 G437 L438 E460 | E427-T434 WeakPolarHBondContact O-CA 3.27Å; R428-T434 HydrophobicContact CG-CG2 3.7Å; T434-A436 PolarHBondContact O-N 3.43Å; T434-G437 PolarHBondContact O-N 2.95Å; T434-G437 VanDerWaalsContact O-N 3.17Å; T434-G437 PolarHBondContact OG1-N 2.68Å; T434-G437 VanDerWaalsContact OG1-N 3.15Å; T434-L438 WeakPolarHBondContact O-CB 3.45Å; T434-L438 PolarHBondContact O-N 3.31Å; T434-E460 VanDerWaalsContact CB-OE1 3.28Å; T434-E460 WeakPolarHBondContact CB-OE1 3.49Å; T434-E460 WeakPolarHBondContact CG2-OE1 3.4Å; T434-E460 VanDerWaalsContact CG2-OE2 3.27Å; T434-E460 WeakPolarHBondContact CG2-OE2 3.46Å; T434-E460 VanDerWaalsContact OG1-CD 3.25Å; T434-E460 PolarHBondContact OG1-OE1 3.18Å; T434-E460 PolarHBondContact OG1-OE2 3.42Å | ||
| 435 | P | 93.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -54.7 | -35.1 | 168.9 | -25.9 | 36.8 | 0 | 0 | 0 | 112.7 | L401 H402 A405 L425 A439 M451 | L401-P435 HydrophobicContact CB-CB 4.33Å; L401-P435 HydrophobicContact CB-CG 3.97Å; H402-P435 HydrophobicContact CB-CG 4.42Å; A405-P435 HydrophobicContact CB-CB 3.94Å; A405-P435 WeakPolarHBondContact CB-O 3.23Å; L425-P435 HydrophobicContact CD2-CB 4.3Å; L425-P435 HydrophobicContact CD2-CG 4.3Å; L425-P435 VanDerWaalsContact O-CD 3.24Å; L425-P435 WeakPolarHBondContact O-CD 3.45Å; P435-A439 VanDerWaalsContact O-CB 3.3Å; P435-A439 WeakPolarHBondContact O-CB 3.47Å; P435-A439 PolarHBondContact O-N 2.95Å; P435-M451 HydrophobicContact CB-SD 4Å |
| 436 | A | 94.1 | Very high | 93.4 | Very high | 1 Ų | 1 | 44.5 Ų | 44.5 | 1% | 0.008 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.1 | -52.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | T434 L438 A439 I440 M451 L470 | T434-A436 PolarHBondContact O-N 3.43Å; A436-L438 VanDerWaalsContact C-N 3.27Å; A436-L438 PolarHBondContact O-N 3.09Å; A436-A439 PolarHBondContact O-N 3.08Å; A436-I440 WeakPolarHBondContact O-CG1 3.49Å; A436-I440 PolarHBondContact O-N 3.38Å; A436-M451 HydrophobicContact CB-CE 4.18Å; A436-M451 HydrophobicContact CB-SD 4.16Å; A436-L470 HydrophobicContact CB-CD1 4.21Å; A436-L470 HydrophobicContact CB-CD2 3.76Å |
| 437 | G | 92.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.1 | -36.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | T434 I440 K441 | T434-G437 PolarHBondContact O-N 2.95Å; T434-G437 VanDerWaalsContact O-N 3.17Å; T434-G437 PolarHBondContact OG1-N 2.68Å; T434-G437 VanDerWaalsContact OG1-N 3.15Å; G437-I440 PolarHBondContact O-N 3.46Å; G437-K441 PolarHBondContact O-N 3.46Å |
| 438 | L | 94.7 | Very high | 93.9 | Very high | 10 Ų | 10 | 37.6 Ų | 37.6 | 5% | 0.052 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -75.6 | -35.8 | 177.9 | -172.8 | 60.7 | 0 | 0 | 0 | 113 | N398 H402 L433 T434 A436 I440 K441 N442 | N398-L438 WeakPolarHBondContact OD1-CD2 3.3Å; H402-L438 HydrophobicContact CB-CD2 3.91Å; L433-L438 HydrophobicContact CB-CB 4.42Å; L433-L438 HydrophobicContact CD1-CD1 4.23Å; T434-L438 WeakPolarHBondContact O-CB 3.45Å; T434-L438 PolarHBondContact O-N 3.31Å; A436-L438 VanDerWaalsContact C-N 3.27Å; A436-L438 PolarHBondContact O-N 3.09Å; L438-I440 VanDerWaalsContact C-N 3.32Å; L438-K441 HydrophobicContact CD1-CD 4.03Å; L438-K441 PolarHBondContact O-N 2.69Å; L438-N442 PolarHBondContact O-N 3.42Å; L438-N442 VanDerWaalsContact O-N 3.1Å |
| 439 | A | 95.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.8 | -39.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | A405 P435 A436 N442 G443 Q444 C447 V448 M451 | A405-A439 HydrophobicContact CB-CB 4.07Å; P435-A439 VanDerWaalsContact O-CB 3.3Å; P435-A439 WeakPolarHBondContact O-CB 3.47Å; P435-A439 PolarHBondContact O-N 2.95Å; A436-A439 PolarHBondContact O-N 3.08Å; A439-N442 PolarHBondContact O-N 2.97Å; A439-G443 PolarHBondContact O-N 2.72Å; A439-Q444 HydrophobicContact CB-CB 4.11Å; A439-Q444 PolarHBondContact O-N 3.5Å; A439-C447 HydrophobicContact CB-CB 4.09Å; A439-V448 HydrophobicContact CB-CG2 3.59Å; A439-M451 HydrophobicContact CB-CE 3.94Å |
| 440 | I | 95.8 | Very high | 94.2 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.9 | -54.2 | 172.1 | -65 | -179.9 | 0 | 0 | 0 | 109.9 | A436 G437 L438 N442 G443 V448 L470 A474 Y477 Q479 I482 L486 | A436-I440 WeakPolarHBondContact O-CG1 3.49Å; A436-I440 PolarHBondContact O-N 3.38Å; G437-I440 PolarHBondContact O-N 3.46Å; L438-I440 VanDerWaalsContact C-N 3.32Å; I440-N442 PolarHBondContact O-N 3.24Å; I440-N442 VanDerWaalsContact O-N 3.07Å; I440-G443 PolarHBondContact O-N 3.02Å; I440-V448 HydrophobicContact CD1-CG1 4.42Å; I440-V448 HydrophobicContact CG1-CG1 4.19Å; I440-V448 HydrophobicContact CG1-CG2 3.66Å; I440-L470 HydrophobicContact CD1-CB 3.66Å; I440-L470 HydrophobicContact CD1-CD2 3.64Å; I440-L470 HydrophobicContact CD1-CG 4.12Å; I440-L470 WeakPolarHBondContact CD1-O 3.34Å; I440-A474 HydrophobicContact CG2-CB 3.99Å; I440-Y477 HydrophobicContact CG2-CD2 4.35Å; I440-Q479 HydrophobicContact CG2-CB 4.4Å; I440-Q479 HydrophobicContact CG2-CG 4.26Å; I440-Q479 VanDerWaalsContact O-CG 3.23Å; I440-Q479 WeakPolarHBondContact O-CG 3.49Å; I440-Q479 PolarHBondContact O-NE2 3.28Å; I440-I482 HydrophobicContact CG1-CG2 4.2Å; I440-L486 HydrophobicContact CD1-CD1 4.21Å |
| 441 | K | 94.9 | Very high | 94.1 | Very high | 65 Ų | 65 | 35.6 Ų | 35.6 | 28% | 0.283 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -47.5 | -42.1 | 178.1 | -173.1 | -175.5 | -177.6 | -169.8 | 0 | 112.7 | E431 L433 G437 L438 Y477 Q479 | E431-K441 IonicContact OE1-NZ 3.66Å; E431-K441 PolarHBondContact OE1-NZ 3.47Å; E431-K441 IonicContact OE2-NZ 3.12Å; E431-K441 PolarHBondContact OE2-NZ 3.06Å; L433-K441 HydrophobicContact CD1-CB 4.41Å; L433-K441 HydrophobicContact CD1-CD 3.88Å; G437-K441 PolarHBondContact O-N 3.46Å; L438-K441 HydrophobicContact CD1-CD 4.03Å; L438-K441 PolarHBondContact O-N 2.69Å; K441-Y477 VanDerWaalsContact CA-CD2 3.47Å; K441-Y477 HydrophobicContact CB-CD2 3.8Å; K441-Y477 HydrophobicContact CB-CE2 3.68Å; K441-Y477 HydrophobicContact CB-CG 4.26Å; K441-Y477 HydrophobicContact CD-CE1 4.4Å; K441-Y477 HydrophobicContact CG-CD1 4.07Å; K441-Y477 HydrophobicContact CG-CD2 4.15Å; K441-Y477 HydrophobicContact CG-CE1 3.89Å; K441-Y477 HydrophobicContact CG-CE2 3.95Å; K441-Y477 HydrophobicContact CG-CG 4.21Å; K441-Q479 PolarHBondContact O-NE2 3.03Å; K441-Q479 VanDerWaalsContact O-NE2 3.14Å |
| 442 | N | 95 | Very high | 94.1 | Very high | 73 Ų | 73 | 31.3 Ų | 31.3 | 39% | 0.39 | 15% | 0.149 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | 1.1 | -178.2 | -71.9 | 18.3 | 0 | 0 | 0 | 115.1 | S406 L438 A439 I440 Q444 | S406-N442 WeakPolarHBondContact CB-ND2 3.28Å; S406-N442 WeakPolarHBondContact O-CB 3.47Å; S406-N442 PolarHBondContact O-ND2 3.19Å; L438-N442 PolarHBondContact O-N 3.42Å; L438-N442 VanDerWaalsContact O-N 3.1Å; A439-N442 PolarHBondContact O-N 2.97Å; I440-N442 PolarHBondContact O-N 3.24Å; I440-N442 VanDerWaalsContact O-N 3.07Å; N442-Q444 HydrophobicContact CB-CG 3.85Å |
| 443 | G | 95.1 | Very high | 93.9 | Very high | 28 Ų | 28 | 27.4 Ų | 27.4 | 29% | 0.289 | 14% | 0.139 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 77.6 | 19.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | A439 I440 L445 Q479 | A439-G443 PolarHBondContact O-N 2.72Å; I440-G443 PolarHBondContact O-N 3.02Å; G443-L445 PolarHBondContact O-N 3.04Å; G443-Q479 VanDerWaalsContact CA-OE1 3.26Å |
| 444 | Q | 96.7 | Very high | 93.5 | Very high | 54 Ų | 54 | 33.4 Ų | 33.4 | 25% | 0.252 | 17% | 0.167 | S | C | . | . | trans | -87 | 70.3 | -169 | -55.4 | -66.7 | 12.6 | 0 | 0 | 112.7 | A405 S406 Q407 A439 N442 E446 C447 V448 | A405-Q444 WeakPolarHBondContact O-CB 3.28Å; A405-Q444 WeakPolarHBondContact O-CG 3.31Å; S406-Q444 WeakPolarHBondContact O-CG 3.49Å; S406-Q444 PolarHBondContact O-NE2 2.87Å; Q407-Q444 PolarHBondContact O-NE2 3.32Å; A439-Q444 HydrophobicContact CB-CB 4.11Å; A439-Q444 PolarHBondContact O-N 3.5Å; N442-Q444 HydrophobicContact CB-CG 3.85Å; Q444-E446 PolarHBondContact O-N 2.93Å; Q444-C447 HydrophobicContact CB-CB 4.4Å; Q444-C447 PolarHBondContact O-N 3.34Å; Q444-V448 PolarHBondContact O-N 3.34Å | ||
| 445 | L | 95.3 | Very high | 93 | Very high | 47 Ų | 47 | 34 Ų | 34 | 25% | 0.246 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -47.8 | -51 | -173.9 | 177.8 | 64.7 | 0 | 0 | 0 | 114.2 | G443 C447 V448 R449 I482 W485 | G443-L445 PolarHBondContact O-N 3.04Å; L445-C447 VanDerWaalsContact C-N 3.29Å; L445-C447 PolarHBondContact O-N 3.32Å; L445-V448 PolarHBondContact O-N 2.95Å; L445-V448 VanDerWaalsContact O-N 3.17Å; L445-R449 HydrophobicContact CD1-CG 3.88Å; L445-R449 HydrophobicContact CG-CG 4.11Å; L445-R449 WeakPolarHBondContact O-CB 3.42Å; L445-R449 VanDerWaalsContact O-CG 3.3Å; L445-R449 WeakPolarHBondContact O-CG 3.44Å; L445-R449 PolarHBondContact O-N 3.46Å; L445-I482 HydrophobicContact CB-CG1 4.18Å; L445-I482 HydrophobicContact CD1-CB 4.36Å; L445-I482 HydrophobicContact CD1-CG1 4Å; L445-W485 HydrophobicContact CD1-CB 3.94Å; L445-W485 HydrophobicContact CD1-CG 4.36Å |
| 446 | E | 95.3 | Very high | 92.2 | Very high | 100 Ų | 100 | 41 Ų | 41 | 47% | 0.467 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -66.7 | -30.2 | -173 | -59.7 | -58.3 | 103.8 | 0 | 0 | 112.9 | A410 Q444 R449 W450 | A410-E446 HydrophobicContact CB-CB 4.26Å; Q444-E446 PolarHBondContact O-N 2.93Å; E446-R449 WeakPolarHBondContact OE1-CD 3.45Å; E446-R449 IonicContact OE1-CZ 3.74Å; E446-R449 IonicContact OE1-NE 2.77Å; E446-R449 IonicContact OE1-NH1 3.35Å; E446-R449 PolarHBondContact OE1-NH1 3.33Å; E446-R449 IonicContact OE2-CZ 3.04Å; E446-R449 IonicContact OE2-NH1 3.7Å; E446-R449 PolarHBondContact OE2-NH1 3.5Å; E446-W450 PolarHBondContact O-N 3.33Å |
| 447 | C | 94.8 | Very high | 91.3 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -67.7 | -47 | 172 | -67.5 | 0 | 0 | 0 | 0 | 111.3 | L413 A439 Q444 L445 R449 W450 M451 | L413-C447 HydrophobicContact CD2-CB 3.9Å; A439-C447 HydrophobicContact CB-CB 4.09Å; Q444-C447 HydrophobicContact CB-CB 4.4Å; Q444-C447 PolarHBondContact O-N 3.34Å; L445-C447 VanDerWaalsContact C-N 3.29Å; L445-C447 PolarHBondContact O-N 3.32Å; C447-R449 VanDerWaalsContact C-N 3.34Å; C447-R449 PolarHBondContact O-N 3.04Å; C447-W450 PolarHBondContact O-N 3.39Å; C447-M451 HydrophobicContact CB-CE 4.03Å; C447-M451 VanDerWaalsContact O-CE 3.22Å; C447-M451 WeakPolarHBondContact O-CE 3.42Å; C447-M451 WeakPolarHBondContact O-CG 3.46Å; C447-M451 PolarHBondContact O-N 3.06Å |
| 448 | V | 94.5 | Very high | 90.5 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.7 | -43.6 | 177.3 | -179.8 | 0 | 0 | 0 | 0 | 110.9 | A439 I440 Q444 L445 W450 M451 V452 I482 L486 | A439-V448 HydrophobicContact CB-CG2 3.59Å; I440-V448 HydrophobicContact CD1-CG1 4.42Å; I440-V448 HydrophobicContact CG1-CG1 4.19Å; I440-V448 HydrophobicContact CG1-CG2 3.66Å; Q444-V448 PolarHBondContact O-N 3.34Å; L445-V448 PolarHBondContact O-N 2.95Å; L445-V448 VanDerWaalsContact O-N 3.17Å; V448-W450 PolarHBondContact O-N 3.49Å; V448-M451 PolarHBondContact O-N 3.4Å; V448-V452 HydrophobicContact CG1-CG2 4.17Å; V448-V452 WeakPolarHBondContact O-CB 3.28Å; V448-V452 WeakPolarHBondContact O-CG2 3.45Å; V448-V452 PolarHBondContact O-N 3.33Å; V448-I482 HydrophobicContact CB-CG2 4.22Å; V448-I482 HydrophobicContact CG1-CG2 3.85Å; V448-I482 HydrophobicContact CG2-CD1 4.28Å; V448-I482 HydrophobicContact CG2-CG2 4.32Å; V448-L486 HydrophobicContact CG1-CD2 4.24Å |
| 449 | R | 93.9 | Very high | 89.7 | Confident | 95 Ų | 95 | 47.1 Ų | 47.1 | 36% | 0.358 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -55 | -53.6 | 177.4 | -76.3 | -179.7 | 60.6 | -143.1 | -15.4 | 111.6 | L445 E446 C447 V452 S453 W485 | L445-R449 HydrophobicContact CD1-CG 3.88Å; L445-R449 HydrophobicContact CG-CG 4.11Å; L445-R449 WeakPolarHBondContact O-CB 3.42Å; L445-R449 VanDerWaalsContact O-CG 3.3Å; L445-R449 WeakPolarHBondContact O-CG 3.44Å; L445-R449 PolarHBondContact O-N 3.46Å; E446-R449 WeakPolarHBondContact OE1-CD 3.45Å; E446-R449 IonicContact OE1-CZ 3.74Å; E446-R449 IonicContact OE1-NE 2.77Å; E446-R449 IonicContact OE1-NH1 3.35Å; E446-R449 PolarHBondContact OE1-NH1 3.33Å; E446-R449 IonicContact OE2-CZ 3.04Å; E446-R449 IonicContact OE2-NH1 3.7Å; E446-R449 PolarHBondContact OE2-NH1 3.5Å; C447-R449 VanDerWaalsContact C-N 3.34Å; C447-R449 PolarHBondContact O-N 3.04Å; R449-V452 PolarHBondContact O-N 3.01Å; R449-S453 WeakPolarHBondContact O-CB 3.47Å; R449-S453 PolarHBondContact O-N 3.33Å; R449-S453 PolarHBondContact O-OG 3.41Å; R449-S453 VanDerWaalsContact O-OG 3.05Å; R449-W485 HydrophobicContact CB-CH2 4.39Å; R449-W485 HydrophobicContact CB-CZ2 4.27Å; R449-W485 HydrophobicContact CG-CD2 3.56Å; R449-W485 HydrophobicContact CG-CE3 3.89Å; R449-W485 HydrophobicContact CG-CG 3.97Å; R449-W485 HydrophobicContact CG-CH2 4.33Å; R449-W485 HydrophobicContact CG-CZ2 4.04Å; R449-W485 HydrophobicContact CG-CZ3 4.25Å |
| 450 | W | 94 | Very high | 89 | Confident | 46 Ų | 46 | 48 Ų | 48 | 17% | 0.174 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.7 | -44.2 | -178.7 | 175.6 | 70.6 | 0 | 0 | 0 | 112.9 | L413 Q414 T417 E446 C447 V448 V452 S453 E454 T455 | L413-W450 HydrophobicContact CD2-CE3 3.92Å; L413-W450 HydrophobicContact CD2-CZ3 4.11Å; L413-W450 HydrophobicContact CG-CE3 4.11Å; L413-W450 HydrophobicContact CG-CZ3 3.88Å; Q414-W450 HydrophobicContact CB-CZ2 4.5Å; Q414-W450 HydrophobicContact CG-CD2 3.59Å; Q414-W450 VanDerWaalsContact CG-CE2 3.44Å; Q414-W450 HydrophobicContact CG-CE3 4.1Å; Q414-W450 HydrophobicContact CG-CG 4Å; Q414-W450 HydrophobicContact CG-CH2 4.32Å; Q414-W450 HydrophobicContact CG-CZ2 3.84Å; Q414-W450 HydrophobicContact CG-CZ3 4.44Å; T417-W450 HydrophobicContact CG2-CH2 4.04Å; E446-W450 PolarHBondContact O-N 3.33Å; C447-W450 PolarHBondContact O-N 3.39Å; V448-W450 PolarHBondContact O-N 3.49Å; W450-V452 PolarHBondContact O-N 2.96Å; W450-S453 PolarHBondContact O-N 3.47Å; W450-E454 VanDerWaalsContact CD1-CG 3.41Å; W450-E454 HydrophobicContact CG-CG 4.39Å; W450-E454 WeakPolarHBondContact O-CB 3.44Å; W450-E454 PolarHBondContact O-N 3.43Å; W450-T455 HydrophobicContact CH2-CG2 3.91Å; W450-T455 HydrophobicContact CZ2-CG2 4.03Å; W450-T455 HydrophobicContact CZ3-CG2 4.35Å |
| 451 | M | 92.3 | Very high | 88.2 | Confident | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.005 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -60.7 | -45.5 | 177.9 | -73.9 | -179 | -77.5 | 0 | 0 | 111.6 | A405 L413 L425 P435 A436 A439 C447 V448 T455 A457 | A405-M451 HydrophobicContact CB-CE 4.09Å; L413-M451 HydrophobicContact CD2-CE 3.92Å; L413-M451 HydrophobicContact CD2-CG 4.01Å; L413-M451 HydrophobicContact CD2-SD 3.97Å; L425-M451 HydrophobicContact CD2-CG 4.26Å; L425-M451 HydrophobicContact CD2-SD 3.88Å; P435-M451 HydrophobicContact CB-SD 4Å; A436-M451 HydrophobicContact CB-CE 4.18Å; A436-M451 HydrophobicContact CB-SD 4.16Å; A439-M451 HydrophobicContact CB-CE 3.94Å; C447-M451 HydrophobicContact CB-CE 4.03Å; C447-M451 VanDerWaalsContact O-CE 3.22Å; C447-M451 WeakPolarHBondContact O-CE 3.42Å; C447-M451 WeakPolarHBondContact O-CG 3.46Å; C447-M451 PolarHBondContact O-N 3.06Å; V448-M451 PolarHBondContact O-N 3.4Å; M451-T455 WeakPolarHBondContact O-CB 3.49Å; M451-T455 PolarHBondContact O-N 3.2Å; M451-T455 PolarHBondContact O-OG1 3.28Å; M451-A457 HydrophobicContact CB-CB 4.26Å |
| 452 | V | 90.1 | Very high | 87.4 | Confident | 1 Ų | 1 | 47.6 Ų | 47.6 | 1% | 0.006 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -77.1 | -25.8 | -175.9 | 173.7 | 0 | 0 | 0 | 0 | 113.1 | V448 R449 W450 L461 L470 W485 L486 F489 | V448-V452 HydrophobicContact CG1-CG2 4.17Å; V448-V452 WeakPolarHBondContact O-CB 3.28Å; V448-V452 WeakPolarHBondContact O-CG2 3.45Å; V448-V452 PolarHBondContact O-N 3.33Å; R449-V452 PolarHBondContact O-N 3.01Å; W450-V452 PolarHBondContact O-N 2.96Å; V452-L461 HydrophobicContact CG1-CD1 3.98Å; V452-L461 HydrophobicContact CG1-CD2 4.16Å; V452-L461 HydrophobicContact CG1-CG 4.31Å; V452-L470 HydrophobicContact CG2-CD1 3.58Å; V452-W485 HydrophobicContact CB-CH2 3.84Å; V452-W485 HydrophobicContact CB-CZ3 3.83Å; V452-W485 HydrophobicContact CG1-CH2 3.81Å; V452-W485 HydrophobicContact CG1-CZ3 3.85Å; V452-W485 HydrophobicContact CG2-CZ3 4.48Å; V452-L486 HydrophobicContact CG2-CD2 4.43Å; V452-F489 HydrophobicContact CG1-CD1 3.8Å; V452-F489 HydrophobicContact CG1-CE1 3.6Å; V452-F489 HydrophobicContact CG1-CZ 4.24Å |
| 453 | S | 87.9 | Confident | 86.6 | Confident | 51 Ų | 51 | 45.8 Ų | 45.8 | 36% | 0.357 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -90.3 | -32.7 | 178 | 71.5 | 0 | 0 | 0 | 0 | 114.6 | R449 W450 | R449-S453 WeakPolarHBondContact O-CB 3.47Å; R449-S453 PolarHBondContact O-N 3.33Å; R449-S453 PolarHBondContact O-OG 3.41Å; R449-S453 VanDerWaalsContact O-OG 3.05Å; W450-S453 PolarHBondContact O-N 3.47Å |
| 454 | E | 84.4 | Confident | 85.9 | Confident | 129 Ų | 129 | 47.3 Ų | 47.3 | 60% | 0.603 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -112.3 | -3.9 | -171.7 | -45.7 | -51.2 | 129.6 | 0 | 0 | 115.2 | W450 | W450-E454 VanDerWaalsContact CD1-CG 3.41Å; W450-E454 HydrophobicContact CG-CG 4.39Å; W450-E454 WeakPolarHBondContact O-CB 3.44Å; W450-E454 PolarHBondContact O-N 3.43Å |
| 455 | T | 81.3 | Confident | 84.8 | Confident | 14 Ų | 14 | 53.8 Ų | 53.8 | 9% | 0.086 | 28% | 0.281 | C | S | . | . | S | Bend | trans | -134.6 | 169.6 | -176.4 | 80.8 | 0 | 0 | 0 | 0 | 112.5 | L425 W450 M451 A457 I458 | L425-T455 HydrophobicContact CD1-CG2 3.79Å; W450-T455 HydrophobicContact CH2-CG2 3.91Å; W450-T455 HydrophobicContact CZ2-CG2 4.03Å; W450-T455 HydrophobicContact CZ3-CG2 4.35Å; M451-T455 WeakPolarHBondContact O-CB 3.49Å; M451-T455 PolarHBondContact O-N 3.2Å; M451-T455 PolarHBondContact O-OG1 3.28Å; T455-A457 PolarHBondContact O-N 3.2Å; T455-A457 WeakPolarHBondContact OG1-CB 3.48Å; T455-A457 PolarHBondContact OG1-N 3.44Å; T455-I458 PolarHBondContact O-N 2.66Å |
| 456 | E | 78.1 | Confident | 84 | Confident | 146 Ų | 146 | 56.8 Ų | 56.8 | 68% | 0.682 | 30% | 0.297 | S | S | * | . | G | 310 helix | trans | -65.1 | -5.2 | 178.5 | -60.1 | -157.5 | 147.6 | 0 | 0 | 114.6 | I458 A459 | E456-I458 PolarHBondContact O-N 2.84Å; E456-A459 WeakPolarHBondContact O-CB 3.34Å; E456-A459 PolarHBondContact O-N 3.37Å |
| 457 | A | 73.8 | Confident | 83.5 | Confident | 2 Ų | 2 | 54.4 Ų | 54.4 | 2% | 0.017 | 29% | 0.286 | C | S | . | . | G | 310 helix | trans | -58.8 | -11.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | M451 T455 A459 E460 | M451-A457 HydrophobicContact CB-CB 4.26Å; T455-A457 PolarHBondContact O-N 3.2Å; T455-A457 WeakPolarHBondContact OG1-CB 3.48Å; T455-A457 PolarHBondContact OG1-N 3.44Å; A457-A459 PolarHBondContact O-N 3.29Å; A457-E460 WeakPolarHBondContact O-CB 3.41Å; A457-E460 PolarHBondContact O-N 3.3Å |
| 458 | I | 77.7 | Confident | 83.2 | Confident | 64 Ų | 64 | 56.2 Ų | 56.2 | 33% | 0.328 | 30% | 0.297 | S | S | . | . | G | 310 helix | trans | -53 | -28.2 | 163.5 | -166.6 | 171.4 | 0 | 0 | 0 | 112.9 | T455 E456 E460 L461 F489 I495 | T455-I458 PolarHBondContact O-N 2.66Å; E456-I458 PolarHBondContact O-N 2.84Å; I458-E460 PolarHBondContact O-N 3.38Å; I458-L461 HydrophobicContact CG1-CD1 3.77Å; I458-L461 VanDerWaalsContact O-CB 3.3Å; I458-L461 WeakPolarHBondContact O-CB 3.26Å; I458-L461 VanDerWaalsContact O-CG 3.28Å; I458-L461 WeakPolarHBondContact O-CG 3.18Å; I458-L461 PolarHBondContact O-N 2.81Å; I458-L461 VanDerWaalsContact O-N 3.13Å; I458-F489 HydrophobicContact CD1-CE1 3.77Å; I458-F489 HydrophobicContact CD1-CZ 4Å; I458-F489 HydrophobicContact CG1-CE1 4.05Å; I458-I495 HydrophobicContact CG1-CD1 4.48Å |
| 459 | A | 76.3 | Confident | 83.1 | Confident | 74 Ų | 74 | 56.3 Ų | 56.3 | 61% | 0.612 | 30% | 0.298 | S | S | * | . | G | 310 helix | trans | -64.4 | -25.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | E456 A457 L461 S462 | E456-A459 WeakPolarHBondContact O-CB 3.34Å; E456-A459 PolarHBondContact O-N 3.37Å; A457-A459 PolarHBondContact O-N 3.29Å; A459-L461 PolarHBondContact O-N 3.35Å; A459-S462 PolarHBondContact O-N 2.92Å |
| 460 | E | 81.1 | Confident | 83 | Confident | 17 Ų | 17 | 51.8 Ų | 51.8 | 8% | 0.079 | 28% | 0.281 | C | S | . | . | G | 310 helix | trans | -74.3 | -0.3 | 174.8 | -59 | -158.6 | -100.6 | 0 | 0 | 113.4 | R428 T434 A457 I458 S462 S469 L470 | R428-E460 IonicContact CZ-OE2 3.96Å; R428-E460 IonicContact NH1-OE2 2.62Å; R428-E460 IonicContact NH2-OE2 2.87Å; R428-E460 PolarHBondContact NH2-OE2 2.9Å; T434-E460 VanDerWaalsContact CB-OE1 3.28Å; T434-E460 WeakPolarHBondContact CB-OE1 3.49Å; T434-E460 WeakPolarHBondContact CG2-OE1 3.4Å; T434-E460 VanDerWaalsContact CG2-OE2 3.27Å; T434-E460 WeakPolarHBondContact CG2-OE2 3.46Å; T434-E460 VanDerWaalsContact OG1-CD 3.25Å; T434-E460 PolarHBondContact OG1-OE1 3.18Å; T434-E460 PolarHBondContact OG1-OE2 3.42Å; A457-E460 WeakPolarHBondContact O-CB 3.41Å; A457-E460 PolarHBondContact O-N 3.3Å; I458-E460 PolarHBondContact O-N 3.38Å; E460-S462 VanDerWaalsContact C-N 3.35Å; E460-S469 CarbonylContact O-C 3.56Å; E460-S469 WeakPolarHBondContact O-CA 3.3Å; E460-S469 WeakPolarHBondContact O-CB 2.76Å; E460-L470 HydrophobicContact CB-CD1 3.9Å; E460-L470 HydrophobicContact CB-CD2 4.15Å; E460-L470 HydrophobicContact CB-CG 3.69Å; E460-L470 WeakPolarHBondContact O-CG 3.17Å; E460-L470 PolarHBondContact O-N 2.9Å |
| 461 | L | 78.7 | Confident | 82.9 | Confident | 1 Ų | 1 | 49.7 Ų | 49.7 | 1% | 0.005 | 27% | 0.273 | C | S | . | . | G | 310 helix | trans | -73.4 | -27.2 | 169.8 | -61.7 | 178.4 | 0 | 0 | 0 | 112.5 | V452 I458 A459 S469 L470 L486 F489 M490 I495 | V452-L461 HydrophobicContact CG1-CD1 3.98Å; V452-L461 HydrophobicContact CG1-CD2 4.16Å; V452-L461 HydrophobicContact CG1-CG 4.31Å; I458-L461 HydrophobicContact CG1-CD1 3.77Å; I458-L461 VanDerWaalsContact O-CB 3.3Å; I458-L461 WeakPolarHBondContact O-CB 3.26Å; I458-L461 VanDerWaalsContact O-CG 3.28Å; I458-L461 WeakPolarHBondContact O-CG 3.18Å; I458-L461 PolarHBondContact O-N 2.81Å; I458-L461 VanDerWaalsContact O-N 3.13Å; A459-L461 PolarHBondContact O-N 3.35Å; L461-S469 WeakPolarHBondContact O-CB 3.29Å; L461-S469 PolarHBondContact O-OG 3.34Å; L461-L470 HydrophobicContact CD2-CB 4.23Å; L461-L470 HydrophobicContact CD2-CD1 4.15Å; L461-L486 HydrophobicContact CD2-CD2 3.7Å; L461-F489 HydrophobicContact CD1-CD1 3.98Å; L461-F489 HydrophobicContact CD1-CE1 4.01Å; L461-M490 HydrophobicContact CD1-CG 4Å; L461-M490 HydrophobicContact CD2-CG 4.4Å; L461-M490 HydrophobicContact CD2-SD 4.32Å; L461-I495 HydrophobicContact CD1-CD1 3.59Å |
| 462 | S | 79.1 | Confident | 83 | Confident | 57 Ų | 57 | 49.8 Ų | 49.8 | 40% | 0.399 | 27% | 0.273 | S | S | . | . | S | Bend | trans | -90.2 | 150.1 | 172.4 | -72.8 | 0 | 0 | 0 | 0 | 111.7 | A459 E460 S469 E499 | A459-S462 PolarHBondContact O-N 2.92Å; E460-S462 VanDerWaalsContact C-N 3.35Å; S462-S469 VanDerWaalsContact O-CB 3.27Å; S462-S469 WeakPolarHBondContact O-CB 3.46Å; S462-E499 WeakPolarHBondContact CA-OE2 3.4Å |
| 463 | C | 77.8 | Confident | 83.2 | Confident | 34 Ų | 34 | 50.6 Ų | 50.6 | 23% | 0.23 | 28% | 0.277 | C | S | . | . | P | Polyproline II helix | trans | -73.4 | 136.6 | 177.9 | -84.6 | 0 | 0 | 0 | 0 | 112.3 | S469 H472 E499 V500 | C463-S469 PolarHBondContact SG-N 2.87Å; C463-H472 PolarHBondContact SG-CE1 2.69Å; C463-E499 PolarHBondContact N-OE2 2.92Å; C463-V500 WeakPolarHBondContact CB-O 3.41Å; C463-V500 PolarHBondContact SG-O 3.25Å |
| 464 | S | 80.3 | Confident | 83.5 | Confident | 61 Ų | 61 | 48.2 Ų | 48.2 | 43% | 0.427 | 26% | 0.26 | S | S | . | . | P | Polyproline II helix | trans | -96.7 | 155.8 | 171.6 | -177.5 | 0 | 0 | 0 | 0 | 110.6 | D466 F467 | S464-D466 PolarHBondContact O-N 2.93Å; S464-D466 VanDerWaalsContact O-N 3.12Å; S464-F467 PolarHBondContact N-O 3.41Å; S464-F467 PolarHBondContact O-N 3.2Å |
| 465 | K | 73.2 | Confident | 84 | Confident | 189 Ų | 189 | 42 Ų | 42 | 82% | 0.822 | 23% | 0.231 | S | C | * | . | S | Bend | trans | -55.9 | -29.9 | 176.8 | -68.1 | -177.6 | 179.9 | 177.1 | 0 | 112.9 | Q502 | K465-Q502 WeakPolarHBondContact O-CG 3.48Å; K465-Q502 PolarHBondContact O-NE2 3.46Å |
| 466 | D | 79.7 | Confident | 84.7 | Confident | 110 Ų | 110 | 42.9 Ų | 42.9 | 59% | 0.588 | 24% | 0.237 | S | C | * | . | S | Bend | trans | -109 | -14.3 | -174.6 | -58.3 | -74.9 | 0 | 0 | 0 | 113.6 | S464 Q502 | S464-D466 PolarHBondContact O-N 2.93Å; S464-D466 VanDerWaalsContact O-N 3.12Å; D466-Q502 PolarHBondContact O-NE2 3.18Å |
| 467 | F | 85.4 | Confident | 85.5 | Confident | 51 Ų | 51 | 39.1 Ų | 39.1 | 22% | 0.224 | 22% | 0.217 | C | C | . | . | S | Bend | trans | -144.9 | 136 | -175 | -46.3 | -76.5 | 0 | 0 | 0 | 112.8 | K432 S464 | K432-F467 HydrophobicContact CB-CD1 4.18Å; K432-F467 HydrophobicContact CB-CE1 3.89Å; K432-F467 HydrophobicContact CD-CE1 4.09Å; K432-F467 HydrophobicContact CG-CE1 4.25Å; S464-F467 PolarHBondContact N-O 3.41Å; S464-F467 PolarHBondContact O-N 3.2Å |
| 468 | P | 87.8 | Confident | 86.5 | Confident | 37 Ų | 37 | 40 Ų | 40 | 24% | 0.24 | 23% | 0.226 | C | C | . | . | trans | -70.3 | 157.6 | 173.3 | 33.4 | -36.6 | 0 | 0 | 0 | 111.1 | H472 Y473 D501 | P468-H472 HydrophobicContact CB-CB 3.93Å; P468-Y473 HydrophobicContact CG-CE1 4.03Å; P468-Y473 HydrophobicContact CG-CE2 4.27Å; P468-Y473 WeakPolarHBondContact O-CE2 3.38Å; P468-D501 HydrophobicContact CB-CB 4.08Å | ||
| 469 | S | 91.3 | Very high | 87.4 | Confident | 3 Ų | 3 | 39 Ų | 39 | 2% | 0.021 | 22% | 0.22 | C | C | . | . | trans | -82.4 | 167.8 | -175.2 | 105.4 | 0 | 0 | 0 | 0 | 114 | E460 L461 S462 C463 I471 H472 Y473 | E460-S469 CarbonylContact O-C 3.56Å; E460-S469 WeakPolarHBondContact O-CA 3.3Å; E460-S469 WeakPolarHBondContact O-CB 2.76Å; L461-S469 WeakPolarHBondContact O-CB 3.29Å; L461-S469 PolarHBondContact O-OG 3.34Å; S462-S469 VanDerWaalsContact O-CB 3.27Å; S462-S469 WeakPolarHBondContact O-CB 3.46Å; C463-S469 PolarHBondContact SG-N 2.87Å; S469-I471 PolarHBondContact O-N 2.92Å; S469-I471 VanDerWaalsContact O-N 3.15Å; S469-I471 WeakPolarHBondContact OG-CG2 3.35Å; S469-H472 WeakPolarHBondContact O-CA 3.34Å; S469-H472 WeakPolarHBondContact O-CB 3.49Å; S469-H472 PolarHBondContact O-N 2.87Å; S469-H472 PolarHBondContact OG-ND1 3.05Å; S469-Y473 WeakPolarHBondContact O-CD2 3.45Å; S469-Y473 PolarHBondContact O-N 2.78Å; S469-Y473 VanDerWaalsContact O-N 3.11Å | ||
| 470 | L | 92.1 | Very high | 88.3 | Confident | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -53.5 | -34.3 | -179.4 | -64.6 | -179.3 | 0 | 0 | 0 | 114 | A436 I440 V452 E460 L461 H472 Y473 A474 L486 | A436-L470 HydrophobicContact CB-CD1 4.21Å; A436-L470 HydrophobicContact CB-CD2 3.76Å; I440-L470 HydrophobicContact CD1-CB 3.66Å; I440-L470 HydrophobicContact CD1-CD2 3.64Å; I440-L470 HydrophobicContact CD1-CG 4.12Å; I440-L470 WeakPolarHBondContact CD1-O 3.34Å; V452-L470 HydrophobicContact CG2-CD1 3.58Å; E460-L470 HydrophobicContact CB-CD1 3.9Å; E460-L470 HydrophobicContact CB-CD2 4.15Å; E460-L470 HydrophobicContact CB-CG 3.69Å; E460-L470 WeakPolarHBondContact O-CG 3.17Å; E460-L470 PolarHBondContact O-N 2.9Å; L461-L470 HydrophobicContact CD2-CB 4.23Å; L461-L470 HydrophobicContact CD2-CD1 4.15Å; L470-H472 VanDerWaalsContact C-N 3.31Å; L470-H472 PolarHBondContact O-N 3.47Å; L470-Y473 HydrophobicContact CD2-CD2 4.44Å; L470-Y473 PolarHBondContact O-N 3.27Å; L470-A474 WeakPolarHBondContact O-CB 3.49Å; L470-A474 PolarHBondContact O-N 3.35Å; L470-L486 HydrophobicContact CB-CD1 4.31Å |
| 471 | I | 93.3 | Very high | 89 | Confident | 1 Ų | 1 | 46.8 Ų | 46.8 | 1% | 0.005 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -67 | -34.1 | 176.7 | -161.5 | -179.6 | 0 | 0 | 0 | 111.8 | S469 A474 G475 L483 L487 M490 A507 L523 | S469-I471 PolarHBondContact O-N 2.92Å; S469-I471 VanDerWaalsContact O-N 3.15Å; S469-I471 WeakPolarHBondContact OG-CG2 3.35Å; I471-A474 PolarHBondContact O-N 3.05Å; I471-G475 PolarHBondContact O-N 3.23Å; I471-L483 HydrophobicContact CD1-CD1 4.23Å; I471-L483 HydrophobicContact CG1-CD1 3.51Å; I471-L487 HydrophobicContact CD1-CD2 3.79Å; I471-L487 HydrophobicContact CD1-CG 4.42Å; I471-M490 HydrophobicContact CB-SD 4.38Å; I471-M490 HydrophobicContact CD1-CE 4.15Å; I471-M490 HydrophobicContact CD1-SD 4.08Å; I471-A507 HydrophobicContact CD1-CB 4.04Å; I471-A507 HydrophobicContact CG1-CB 3.9Å; I471-A507 HydrophobicContact CG2-CB 4.11Å; I471-L523 HydrophobicContact CD1-CD2 4.14Å |
| 472 | H | 93.8 | Very high | 89.8 | Confident | 3 Ų | 3 | 46.9 Ų | 46.9 | 1% | 0.014 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -71.9 | -41 | 176 | -62.5 | 81.9 | 0 | 0 | 0 | 111 | C463 P468 S469 L470 A474 G475 C476 E499 N505 A507 | C463-H472 PolarHBondContact SG-CE1 2.69Å; P468-H472 HydrophobicContact CB-CB 3.93Å; S469-H472 WeakPolarHBondContact O-CA 3.34Å; S469-H472 WeakPolarHBondContact O-CB 3.49Å; S469-H472 PolarHBondContact O-N 2.87Å; S469-H472 PolarHBondContact OG-ND1 3.05Å; L470-H472 VanDerWaalsContact C-N 3.31Å; L470-H472 PolarHBondContact O-N 3.47Å; H472-A474 VanDerWaalsContact C-N 3.33Å; H472-A474 PolarHBondContact O-N 2.94Å; H472-G475 PolarHBondContact O-N 2.96Å; H472-C476 VanDerWaalsContact O-CB 3.26Å; H472-C476 WeakPolarHBondContact O-CB 3.37Å; H472-C476 PolarHBondContact O-N 3.39Å; H472-E499 PolarHBondContact CE1-O 3.32Å; H472-E499 PolarHBondContact NE2-O 3.47Å; H472-N505 PolarHBondContact CD2-O 3.22Å; H472-N505 PolarHBondContact NE2-O 3Å; H472-A507 PolarHBondContact CD2-N 3.38Å; H472-A507 PolarHBondContact NE2-N 2.93Å |
| 473 | Y | 94 | Very high | 90.6 | Very high | 19 Ų | 19 | 44.1 Ų | 44.1 | 8% | 0.075 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.1 | -40.2 | 171.3 | -70 | -61.3 | 0 | 0 | 0 | 112.1 | L433 P468 S469 L470 G475 C476 Y477 | L433-Y473 HydrophobicContact CD2-CD1 3.85Å; L433-Y473 HydrophobicContact CD2-CE1 3.25Å; L433-Y473 HydrophobicContact CD2-CE2 4.42Å; P468-Y473 HydrophobicContact CG-CE1 4.03Å; P468-Y473 HydrophobicContact CG-CE2 4.27Å; P468-Y473 WeakPolarHBondContact O-CE2 3.38Å; S469-Y473 WeakPolarHBondContact O-CD2 3.45Å; S469-Y473 PolarHBondContact O-N 2.78Å; S469-Y473 VanDerWaalsContact O-N 3.11Å; L470-Y473 HydrophobicContact CD2-CD2 4.44Å; L470-Y473 PolarHBondContact O-N 3.27Å; Y473-G475 VanDerWaalsContact C-N 3.33Å; Y473-G475 PolarHBondContact O-N 3.45Å; Y473-C476 PolarHBondContact O-N 2.92Å; Y473-Y477 AromaticContact CD1-CE2 3.91Å; Y473-Y477 HydrophobicContact CD1-CE2 3.91Å; Y473-Y477 WeakPolarHBondContact O-CD2 3.31Å; Y473-Y477 PolarHBondContact O-N 3.15Å |
| 474 | A | 95.1 | Very high | 91.4 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -65.9 | -35.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | I440 L470 I471 H472 G478 Q479 L483 L486 | I440-A474 HydrophobicContact CG2-CB 3.99Å; L470-A474 WeakPolarHBondContact O-CB 3.49Å; L470-A474 PolarHBondContact O-N 3.35Å; I471-A474 PolarHBondContact O-N 3.05Å; H472-A474 VanDerWaalsContact C-N 3.33Å; H472-A474 PolarHBondContact O-N 2.94Å; A474-G478 PolarHBondContact O-N 3.36Å; A474-Q479 PolarHBondContact O-N 3.03Å; A474-L483 HydrophobicContact CB-CB 4.01Å; A474-L483 HydrophobicContact CB-CD1 4.26Å; A474-L486 HydrophobicContact CB-CD1 4.06Å |
| 475 | G | 94.5 | Very high | 92.2 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.6 | -39.3 | 168.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | I471 H472 Y473 Y516 | I471-G475 PolarHBondContact O-N 3.23Å; H472-G475 PolarHBondContact O-N 2.96Å; Y473-G475 VanDerWaalsContact C-N 3.33Å; Y473-G475 PolarHBondContact O-N 3.45Å; G475-Y516 WeakPolarHBondContact O-CD2 3.18Å |
| 476 | C | 94.9 | Very high | 93.1 | Very high | 31 Ų | 31 | 36 Ų | 36 | 21% | 0.209 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -68.8 | -32.9 | -178.8 | -170.5 | 0 | 0 | 0 | 0 | 113.5 | H472 Y473 V510 Y516 | H472-C476 VanDerWaalsContact O-CB 3.26Å; H472-C476 WeakPolarHBondContact O-CB 3.37Å; H472-C476 PolarHBondContact O-N 3.39Å; Y473-C476 PolarHBondContact O-N 2.92Å; C476-V510 HydrophobicContact CB-CG1 3.69Å; C476-Y516 VanDerWaalsContact O-CE2 3.26Å; C476-Y516 WeakPolarHBondContact O-CE2 3.32Å |
| 477 | Y | 95.4 | Very high | 93.8 | Very high | 67 Ų | 67 | 30.8 Ų | 30.8 | 26% | 0.263 | 15% | 0.149 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -104.1 | 6.8 | -179.1 | -58.2 | -54.4 | 0 | 0 | 0 | 114.1 | I440 K441 Y473 Q479 | I440-Y477 HydrophobicContact CG2-CD2 4.35Å; K441-Y477 VanDerWaalsContact CA-CD2 3.47Å; K441-Y477 HydrophobicContact CB-CD2 3.8Å; K441-Y477 HydrophobicContact CB-CE2 3.68Å; K441-Y477 HydrophobicContact CB-CG 4.26Å; K441-Y477 HydrophobicContact CD-CE1 4.4Å; K441-Y477 HydrophobicContact CG-CD1 4.07Å; K441-Y477 HydrophobicContact CG-CD2 4.15Å; K441-Y477 HydrophobicContact CG-CE1 3.89Å; K441-Y477 HydrophobicContact CG-CE2 3.95Å; K441-Y477 HydrophobicContact CG-CG 4.21Å; Y473-Y477 AromaticContact CD1-CE2 3.91Å; Y473-Y477 HydrophobicContact CD1-CE2 3.91Å; Y473-Y477 WeakPolarHBondContact O-CD2 3.31Å; Y473-Y477 PolarHBondContact O-N 3.15Å; Y477-Q479 VanDerWaalsContact C-N 3.34Å; Y477-Q479 PolarHBondContact O-N 3.39Å |
| 478 | G | 94.9 | Very high | 94.1 | Very high | 21 Ų | 21 | 31.7 Ų | 31.7 | 22% | 0.216 | 15% | 0.154 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 70.3 | 25.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115 | A474 E480 Y516 | A474-G478 PolarHBondContact O-N 3.36Å; G478-E480 VanDerWaalsContact C-N 3.3Å; G478-E480 PolarHBondContact O-N 2.88Å; G478-Y516 VanDerWaalsContact CA-CD1 3.44Å |
| 479 | Q | 96.3 | Very high | 94.4 | Very high | 43 Ų | 43 | 30.9 Ų | 30.9 | 20% | 0.201 | 15% | 0.147 | C | C | . | . | trans | -89 | 60.5 | -164.8 | -62.9 | -71.5 | 1.8 | 0 | 0 | 112.6 | I440 K441 G443 A474 Y477 K481 I482 L483 | I440-Q479 HydrophobicContact CG2-CB 4.4Å; I440-Q479 HydrophobicContact CG2-CG 4.26Å; I440-Q479 VanDerWaalsContact O-CG 3.23Å; I440-Q479 WeakPolarHBondContact O-CG 3.49Å; I440-Q479 PolarHBondContact O-NE2 3.28Å; K441-Q479 PolarHBondContact O-NE2 3.03Å; K441-Q479 VanDerWaalsContact O-NE2 3.14Å; G443-Q479 VanDerWaalsContact CA-OE1 3.26Å; A474-Q479 PolarHBondContact O-N 3.03Å; Y477-Q479 VanDerWaalsContact C-N 3.34Å; Y477-Q479 PolarHBondContact O-N 3.39Å; Q479-K481 VanDerWaalsContact C-N 3.26Å; Q479-K481 PolarHBondContact O-N 2.82Å; Q479-K481 VanDerWaalsContact O-N 3.08Å; Q479-I482 HydrophobicContact CB-CB 4.27Å; Q479-I482 HydrophobicContact CB-CD1 4.25Å; Q479-I482 HydrophobicContact CB-CG1 4.36Å; Q479-I482 PolarHBondContact O-N 3.26Å; Q479-L483 PolarHBondContact O-N 2.84Å | ||
| 480 | E | 95.8 | Very high | 94.4 | Very high | 93 Ų | 93 | 30.8 Ų | 30.8 | 44% | 0.435 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -45.8 | -43.2 | -173.6 | -169.4 | -169.2 | 108.4 | 0 | 0 | 114.1 | G478 I482 L483 L484 G518 T522 | G478-E480 VanDerWaalsContact C-N 3.3Å; G478-E480 PolarHBondContact O-N 2.88Å; E480-I482 PolarHBondContact O-N 2.97Å; E480-L483 PolarHBondContact O-N 3.45Å; E480-L484 VanDerWaalsContact O-CB 3.26Å; E480-L484 WeakPolarHBondContact O-CB 3.26Å; E480-L484 PolarHBondContact O-N 2.88Å; E480-G518 VanDerWaalsContact OE2-CA 3.31Å; E480-G518 WeakPolarHBondContact OE2-CA 3.46Å; E480-T522 WeakPolarHBondContact CG-OG1 3.47Å |
| 481 | K | 95.7 | Very high | 94.3 | Very high | 162 Ų | 162 | 36 Ų | 36 | 70% | 0.704 | 17% | 0.171 | S | C | * | . | H | α-helix | trans | -66 | -36.3 | 179.5 | -65.9 | 178.2 | -176.8 | 171.4 | 0 | 113.5 | Q479 W485 | Q479-K481 VanDerWaalsContact C-N 3.26Å; Q479-K481 PolarHBondContact O-N 2.82Å; Q479-K481 VanDerWaalsContact O-N 3.08Å; K481-W485 PolarHBondContact O-N 2.97Å |
| 482 | I | 96.1 | Very high | 94.1 | Very high | 2 Ų | 2 | 42 Ų | 42 | 1% | 0.01 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -77.6 | -44 | 177.8 | -54.2 | -178.7 | 0 | 0 | 0 | 109 | I440 L445 V448 Q479 E480 L484 W485 L486 | I440-I482 HydrophobicContact CG1-CG2 4.2Å; L445-I482 HydrophobicContact CB-CG1 4.18Å; L445-I482 HydrophobicContact CD1-CB 4.36Å; L445-I482 HydrophobicContact CD1-CG1 4Å; V448-I482 HydrophobicContact CB-CG2 4.22Å; V448-I482 HydrophobicContact CG1-CG2 3.85Å; V448-I482 HydrophobicContact CG2-CD1 4.28Å; V448-I482 HydrophobicContact CG2-CG2 4.32Å; Q479-I482 HydrophobicContact CB-CB 4.27Å; Q479-I482 HydrophobicContact CB-CD1 4.25Å; Q479-I482 HydrophobicContact CB-CG1 4.36Å; Q479-I482 PolarHBondContact O-N 3.26Å; E480-I482 PolarHBondContact O-N 2.97Å; I482-L484 VanDerWaalsContact C-N 3.32Å; I482-L484 PolarHBondContact O-N 3.04Å; I482-W485 PolarHBondContact O-N 2.96Å; I482-W485 VanDerWaalsContact O-N 3.08Å; I482-L486 HydrophobicContact CG2-CD1 3.88Å; I482-L486 HydrophobicContact CG2-CG 4.09Å; I482-L486 WeakPolarHBondContact O-CB 3.28Å; I482-L486 WeakPolarHBondContact O-CG 3.4Å; I482-L486 PolarHBondContact O-N 2.91Å |
| 483 | L | 95.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -54.4 | -46.8 | 174 | -178 | 57.3 | 0 | 0 | 0 | 111.7 | I471 A474 Q479 E480 W485 L486 L487 C519 L523 | I471-L483 HydrophobicContact CD1-CD1 4.23Å; I471-L483 HydrophobicContact CG1-CD1 3.51Å; A474-L483 HydrophobicContact CB-CB 4.01Å; A474-L483 HydrophobicContact CB-CD1 4.26Å; Q479-L483 PolarHBondContact O-N 2.84Å; E480-L483 PolarHBondContact O-N 3.45Å; L483-W485 VanDerWaalsContact C-N 3.34Å; L483-W485 PolarHBondContact O-N 3.46Å; L483-L486 PolarHBondContact O-N 3.23Å; L483-L487 HydrophobicContact CD1-CD1 4.04Å; L483-L487 HydrophobicContact CD1-CG 4.19Å; L483-L487 HydrophobicContact CG-CD1 3.91Å; L483-L487 VanDerWaalsContact O-CB 3.29Å; L483-L487 WeakPolarHBondContact O-CB 3.48Å; L483-L487 WeakPolarHBondContact O-CD1 3.19Å; L483-L487 WeakPolarHBondContact O-CG 3.49Å; L483-L487 PolarHBondContact O-N 3.05Å; L483-C519 HydrophobicContact CD2-CB 3.45Å; L483-C519 VanDerWaalsContact CD2-CB 3.45Å; L483-L523 HydrophobicContact CD1-CD2 4.25Å; L483-L523 HydrophobicContact CD1-CG 4.33Å; L483-L523 HydrophobicContact CD2-CD1 4.03Å; L483-L523 HydrophobicContact CD2-CG 4.07Å |
| 484 | L | 95.4 | Very high | 93.5 | Very high | 62 Ų | 62 | 49.3 Ų | 49.3 | 33% | 0.325 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -58.8 | -40.9 | 175 | 176.2 | 62.3 | 0 | 0 | 0 | 112.7 | E480 I482 Q488 T522 Y526 | E480-L484 VanDerWaalsContact O-CB 3.26Å; E480-L484 WeakPolarHBondContact O-CB 3.26Å; E480-L484 PolarHBondContact O-N 2.88Å; I482-L484 VanDerWaalsContact C-N 3.32Å; I482-L484 PolarHBondContact O-N 3.04Å; L484-Q488 WeakPolarHBondContact O-CB 3.26Å; L484-Q488 PolarHBondContact O-N 2.87Å; L484-Q488 VanDerWaalsContact O-N 3.11Å; L484-T522 HydrophobicContact CB-CG2 3.98Å; L484-T522 HydrophobicContact CD1-CG2 3.98Å; L484-Y526 HydrophobicContact CD1-CD2 4.5Å; L484-Y526 HydrophobicContact CD1-CE2 3.48Å; L484-Y526 VanDerWaalsContact CD1-CE2 3.48Å |
| 485 | W | 95.3 | Very high | 93.1 | Very high | 52 Ų | 52 | 51.3 Ų | 51.3 | 20% | 0.197 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -72.7 | -42.8 | 177.3 | -178.9 | 79.2 | 0 | 0 | 0 | 112.3 | L445 R449 V452 K481 I482 L483 L487 Q488 F489 | L445-W485 HydrophobicContact CD1-CB 3.94Å; L445-W485 HydrophobicContact CD1-CG 4.36Å; R449-W485 HydrophobicContact CB-CH2 4.39Å; R449-W485 HydrophobicContact CB-CZ2 4.27Å; R449-W485 HydrophobicContact CG-CD2 3.56Å; R449-W485 HydrophobicContact CG-CE3 3.89Å; R449-W485 HydrophobicContact CG-CG 3.97Å; R449-W485 HydrophobicContact CG-CH2 4.33Å; R449-W485 HydrophobicContact CG-CZ2 4.04Å; R449-W485 HydrophobicContact CG-CZ3 4.25Å; V452-W485 HydrophobicContact CB-CH2 3.84Å; V452-W485 HydrophobicContact CB-CZ3 3.83Å; V452-W485 HydrophobicContact CG1-CH2 3.81Å; V452-W485 HydrophobicContact CG1-CZ3 3.85Å; V452-W485 HydrophobicContact CG2-CZ3 4.48Å; K481-W485 PolarHBondContact O-N 2.97Å; I482-W485 PolarHBondContact O-N 2.96Å; I482-W485 VanDerWaalsContact O-N 3.08Å; L483-W485 VanDerWaalsContact C-N 3.34Å; L483-W485 PolarHBondContact O-N 3.46Å; W485-L487 VanDerWaalsContact C-N 3.35Å; W485-L487 PolarHBondContact O-N 3.47Å; W485-Q488 PolarHBondContact O-N 2.85Å; W485-F489 HydrophobicContact CH2-CB 4.18Å; W485-F489 HydrophobicContact CH2-CD1 4.43Å; W485-F489 HydrophobicContact CH2-CD2 4Å; W485-F489 HydrophobicContact CH2-CE2 4.5Å; W485-F489 AromaticContact CH2-CG 3.95Å; W485-F489 HydrophobicContact CH2-CG 3.95Å; W485-F489 HydrophobicContact CZ2-CB 4.06Å; W485-F489 AromaticContact CZ2-CD2 3.76Å; W485-F489 HydrophobicContact CZ2-CD2 3.76Å; W485-F489 HydrophobicContact CZ2-CE2 4.44Å; W485-F489 HydrophobicContact CZ2-CG 4.01Å; W485-F489 HydrophobicContact CZ3-CB 4.48Å; W485-F489 WeakPolarHBondContact O-CB 3.23Å; W485-F489 PolarHBondContact O-N 2.83Å |
| 486 | L | 93.7 | Very high | 92.5 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.2 | -45.9 | 175.3 | -70 | 171.3 | 0 | 0 | 0 | 110.7 | I440 V448 V452 L461 L470 A474 I482 L483 Q488 F489 M490 | I440-L486 HydrophobicContact CD1-CD1 4.21Å; V448-L486 HydrophobicContact CG1-CD2 4.24Å; V452-L486 HydrophobicContact CG2-CD2 4.43Å; L461-L486 HydrophobicContact CD2-CD2 3.7Å; L470-L486 HydrophobicContact CB-CD1 4.31Å; A474-L486 HydrophobicContact CB-CD1 4.06Å; I482-L486 HydrophobicContact CG2-CD1 3.88Å; I482-L486 HydrophobicContact CG2-CG 4.09Å; I482-L486 WeakPolarHBondContact O-CB 3.28Å; I482-L486 WeakPolarHBondContact O-CG 3.4Å; I482-L486 PolarHBondContact O-N 2.91Å; L483-L486 PolarHBondContact O-N 3.23Å; L486-Q488 PolarHBondContact O-N 3.1Å; L486-F489 PolarHBondContact O-N 3.32Å; L486-M490 VanDerWaalsContact O-CB 3.29Å; L486-M490 WeakPolarHBondContact O-CB 3.45Å; L486-M490 WeakPolarHBondContact O-CG 3.17Å; L486-M490 PolarHBondContact O-N 3.27Å |
| 487 | L | 93.3 | Very high | 92 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59.8 | -44.2 | 175.7 | -75.2 | 167.4 | 0 | 0 | 0 | 112.3 | I471 L483 W485 Q491 L497 T522 L523 Y526 | I471-L487 HydrophobicContact CD1-CD2 3.79Å; I471-L487 HydrophobicContact CD1-CG 4.42Å; L483-L487 HydrophobicContact CD1-CD1 4.04Å; L483-L487 HydrophobicContact CD1-CG 4.19Å; L483-L487 HydrophobicContact CG-CD1 3.91Å; L483-L487 VanDerWaalsContact O-CB 3.29Å; L483-L487 WeakPolarHBondContact O-CB 3.48Å; L483-L487 WeakPolarHBondContact O-CD1 3.19Å; L483-L487 WeakPolarHBondContact O-CG 3.49Å; L483-L487 PolarHBondContact O-N 3.05Å; W485-L487 VanDerWaalsContact C-N 3.35Å; W485-L487 PolarHBondContact O-N 3.47Å; L487-Q491 WeakPolarHBondContact O-CB 3.31Å; L487-Q491 PolarHBondContact O-N 3.44Å; L487-L497 HydrophobicContact CD2-CD1 3.97Å; L487-L497 HydrophobicContact CD2-CD2 3.87Å; L487-L497 HydrophobicContact CD2-CG 4.38Å; L487-T522 HydrophobicContact CD1-CG2 3.79Å; L487-L523 HydrophobicContact CD1-CD2 4.26Å; L487-L523 HydrophobicContact CD1-CG 4.43Å; L487-L523 HydrophobicContact CD2-CD2 4.07Å; L487-Y526 HydrophobicContact CB-CD1 3.76Å; L487-Y526 HydrophobicContact CB-CD2 4.35Å; L487-Y526 HydrophobicContact CB-CE1 4.14Å; L487-Y526 HydrophobicContact CB-CG 3.88Å; L487-Y526 HydrophobicContact CD1-CD2 4.23Å; L487-Y526 HydrophobicContact CD1-CG 4.17Å; L487-Y526 HydrophobicContact CG-CG 4.44Å |
| 488 | Q | 92.9 | Very high | 91.5 | Very high | 70 Ų | 70 | 53.2 Ų | 53.2 | 33% | 0.327 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.2 | -45.7 | 175.6 | -174.7 | 62.8 | 40.3 | 0 | 0 | 111.8 | L484 W485 L486 Q491 E492 Y526 | L484-Q488 WeakPolarHBondContact O-CB 3.26Å; L484-Q488 PolarHBondContact O-N 2.87Å; L484-Q488 VanDerWaalsContact O-N 3.11Å; W485-Q488 PolarHBondContact O-N 2.85Å; L486-Q488 PolarHBondContact O-N 3.1Å; Q488-Q491 PolarHBondContact O-N 3.25Å; Q488-E492 WeakPolarHBondContact CG-OE1 3.33Å; Q488-E492 PolarHBondContact NE2-OE1 3.45Å; Q488-E492 WeakPolarHBondContact O-CG 3.4Å; Q488-E492 PolarHBondContact O-N 3.29Å; Q488-Y526 HydrophobicContact CB-CE1 4.4Å; Q488-Y526 PolarHBondContact OE1-OH 3.1Å |
| 489 | F | 92.4 | Very high | 91 | Very high | 20 Ų | 20 | 54.5 Ų | 54.5 | 9% | 0.088 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -67.9 | -44.7 | 179.9 | -176.5 | -96.1 | 0 | 0 | 0 | 112.2 | V452 I458 L461 W485 L486 Q491 E492 Q493 | V452-F489 HydrophobicContact CG1-CD1 3.8Å; V452-F489 HydrophobicContact CG1-CE1 3.6Å; V452-F489 HydrophobicContact CG1-CZ 4.24Å; I458-F489 HydrophobicContact CD1-CE1 3.77Å; I458-F489 HydrophobicContact CD1-CZ 4Å; I458-F489 HydrophobicContact CG1-CE1 4.05Å; L461-F489 HydrophobicContact CD1-CD1 3.98Å; L461-F489 HydrophobicContact CD1-CE1 4.01Å; W485-F489 HydrophobicContact CH2-CB 4.18Å; W485-F489 HydrophobicContact CH2-CD1 4.43Å; W485-F489 HydrophobicContact CH2-CD2 4Å; W485-F489 HydrophobicContact CH2-CE2 4.5Å; W485-F489 AromaticContact CH2-CG 3.95Å; W485-F489 HydrophobicContact CH2-CG 3.95Å; W485-F489 HydrophobicContact CZ2-CB 4.06Å; W485-F489 AromaticContact CZ2-CD2 3.76Å; W485-F489 HydrophobicContact CZ2-CD2 3.76Å; W485-F489 HydrophobicContact CZ2-CE2 4.44Å; W485-F489 HydrophobicContact CZ2-CG 4.01Å; W485-F489 HydrophobicContact CZ3-CB 4.48Å; W485-F489 WeakPolarHBondContact O-CB 3.23Å; W485-F489 PolarHBondContact O-N 2.83Å; L486-F489 PolarHBondContact O-N 3.32Å; F489-Q491 VanDerWaalsContact C-N 3.31Å; F489-Q491 PolarHBondContact O-N 3.23Å; F489-E492 PolarHBondContact O-N 3.46Å; F489-E492 VanDerWaalsContact O-N 3.13Å; F489-Q493 HydrophobicContact CD1-CG 4.1Å; F489-Q493 HydrophobicContact CE1-CG 3.75Å; F489-Q493 HydrophobicContact CE2-CG 4.32Å; F489-Q493 HydrophobicContact CZ-CG 3.88Å; F489-Q493 WeakPolarHBondContact O-CG 3.46Å; F489-Q493 PolarHBondContact O-N 3.5Å |
| 490 | M | 91.2 | Very high | 90.8 | Very high | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -59.6 | -42 | 175 | -71.7 | 166.6 | 75.3 | 0 | 0 | 111.1 | L461 I471 L486 E492 Q493 G494 I495 S496 L497 | L461-M490 HydrophobicContact CD1-CG 4Å; L461-M490 HydrophobicContact CD2-CG 4.4Å; L461-M490 HydrophobicContact CD2-SD 4.32Å; I471-M490 HydrophobicContact CB-SD 4.38Å; I471-M490 HydrophobicContact CD1-CE 4.15Å; I471-M490 HydrophobicContact CD1-SD 4.08Å; L486-M490 VanDerWaalsContact O-CB 3.29Å; L486-M490 WeakPolarHBondContact O-CB 3.45Å; L486-M490 WeakPolarHBondContact O-CG 3.17Å; L486-M490 PolarHBondContact O-N 3.27Å; M490-E492 VanDerWaalsContact C-N 3.33Å; M490-E492 PolarHBondContact O-N 3.44Å; M490-Q493 PolarHBondContact O-N 3.08Å; M490-G494 PolarHBondContact O-N 3.23Å; M490-I495 HydrophobicContact CB-CB 4.03Å; M490-I495 HydrophobicContact CB-CG2 4.48Å; M490-I495 HydrophobicContact CE-CG2 3.85Å; M490-I495 HydrophobicContact CG-CB 4.19Å; M490-I495 HydrophobicContact CG-CD1 4.49Å; M490-I495 HydrophobicContact CG-CG2 4.22Å; M490-I495 PolarHBondContact O-N 3.14Å; M490-S496 WeakPolarHBondContact CE-O 3.48Å; M490-L497 HydrophobicContact CB-CD2 3.79Å; M490-L497 HydrophobicContact CE-CD2 4.07Å; M490-L497 HydrophobicContact SD-CD2 4.46Å |
| 491 | Q | 90.6 | Very high | 90.6 | Very high | 111 Ų | 111 | 52.2 Ų | 52.2 | 52% | 0.519 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -65 | -33.4 | 175.5 | -177 | 60 | 89.7 | 0 | 0 | 113 | L487 Q488 F489 | L487-Q491 WeakPolarHBondContact O-CB 3.31Å; L487-Q491 PolarHBondContact O-N 3.44Å; Q488-Q491 PolarHBondContact O-N 3.25Å; F489-Q491 VanDerWaalsContact C-N 3.31Å; F489-Q491 PolarHBondContact O-N 3.23Å |
| 492 | E | 90.6 | Very high | 90.3 | Very high | 126 Ų | 126 | 49.4 Ų | 49.4 | 59% | 0.589 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -74.8 | -34.2 | 175 | -75.5 | 168.4 | -165.4 | 0 | 0 | 112.8 | Q488 F489 M490 | Q488-E492 WeakPolarHBondContact CG-OE1 3.33Å; Q488-E492 PolarHBondContact NE2-OE1 3.45Å; Q488-E492 WeakPolarHBondContact O-CG 3.4Å; Q488-E492 PolarHBondContact O-N 3.29Å; F489-E492 PolarHBondContact O-N 3.46Å; F489-E492 VanDerWaalsContact O-N 3.13Å; M490-E492 VanDerWaalsContact C-N 3.33Å; M490-E492 PolarHBondContact O-N 3.44Å |
| 493 | Q | 87.8 | Confident | 90 | Very high | 109 Ų | 109 | 54.4 Ų | 54.4 | 51% | 0.509 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -85.4 | -7.4 | 176 | -60.4 | -54.4 | -36.8 | 0 | 0 | 113.9 | F489 M490 I495 | F489-Q493 HydrophobicContact CD1-CG 4.1Å; F489-Q493 HydrophobicContact CE1-CG 3.75Å; F489-Q493 HydrophobicContact CE2-CG 4.32Å; F489-Q493 HydrophobicContact CZ-CG 3.88Å; F489-Q493 WeakPolarHBondContact O-CG 3.46Å; F489-Q493 PolarHBondContact O-N 3.5Å; M490-Q493 PolarHBondContact O-N 3.08Å; Q493-I495 VanDerWaalsContact C-N 3.35Å; Q493-I495 HydrophobicContact CB-CD1 3.78Å; Q493-I495 HydrophobicContact CB-CG1 3.85Å; Q493-I495 HydrophobicContact CG-CD1 4.44Å |
| 494 | G | 85.4 | Confident | 89.9 | Confident | 67 Ų | 67 | 54.6 Ų | 54.6 | 69% | 0.691 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73 | 23.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | M490 | M490-G494 PolarHBondContact O-N 3.23Š|
| 495 | I | 86.6 | Confident | 89.8 | Confident | 41 Ų | 41 | 51.9 Ų | 51.9 | 21% | 0.21 | 28% | 0.278 | C | S | . | . | trans | -79.9 | 141.1 | 179.3 | -60.3 | 170.6 | 0 | 0 | 0 | 109.5 | I458 L461 M490 Q493 | I458-I495 HydrophobicContact CG1-CD1 4.48Å; L461-I495 HydrophobicContact CD1-CD1 3.59Å; M490-I495 HydrophobicContact CB-CB 4.03Å; M490-I495 HydrophobicContact CB-CG2 4.48Å; M490-I495 HydrophobicContact CE-CG2 3.85Å; M490-I495 HydrophobicContact CG-CB 4.19Å; M490-I495 HydrophobicContact CG-CD1 4.49Å; M490-I495 HydrophobicContact CG-CG2 4.22Å; M490-I495 PolarHBondContact O-N 3.14Å; Q493-I495 VanDerWaalsContact C-N 3.35Å; Q493-I495 HydrophobicContact CB-CD1 3.78Å; Q493-I495 HydrophobicContact CB-CG1 3.85Å; Q493-I495 HydrophobicContact CG-CD1 4.44Å | ||
| 496 | S | 83.8 | Confident | 89.8 | Confident | 61 Ų | 61 | 49.5 Ų | 49.5 | 43% | 0.427 | 27% | 0.269 | S | S | . | . | trans | -62 | 135.6 | 178.6 | -172.8 | 0 | 0 | 0 | 0 | 112 | M490 D498 | M490-S496 WeakPolarHBondContact CE-O 3.48Å; S496-D498 PolarHBondContact OG-N 2.89Å | ||
| 497 | L | 83.8 | Confident | 89.8 | Confident | 21 Ų | 21 | 49.5 Ų | 49.5 | 11% | 0.11 | 27% | 0.269 | C | S | . | . | S | Bend | trans | -87.1 | -20.8 | 172.3 | -53.2 | -171.7 | 0 | 0 | 0 | 112.5 | L487 M490 E499 Y526 | L487-L497 HydrophobicContact CD2-CD1 3.97Å; L487-L497 HydrophobicContact CD2-CD2 3.87Å; L487-L497 HydrophobicContact CD2-CG 4.38Å; M490-L497 HydrophobicContact CB-CD2 3.79Å; M490-L497 HydrophobicContact CE-CD2 4.07Å; M490-L497 HydrophobicContact SD-CD2 4.46Å; L497-E499 VanDerWaalsContact C-N 3.27Å; L497-E499 PolarHBondContact O-N 2.91Å; L497-Y526 VanDerWaalsContact CD1-O 3.31Å; L497-Y526 WeakPolarHBondContact CD1-O 3.38Å |
| 498 | D | 84.2 | Confident | 89.9 | Confident | 56 Ų | 56 | 49.6 Ų | 49.6 | 30% | 0.299 | 27% | 0.269 | S | S | . | . | trans | -93.3 | 28.6 | -176.5 | -73.9 | -26 | 0 | 0 | 0 | 112.2 | S496 N529 M532 | S496-D498 PolarHBondContact OG-N 2.89Å; D498-N529 WeakPolarHBondContact OD1-CB 3.36Å; D498-N529 PolarHBondContact OD1-N 2.97Å; D498-N529 WeakPolarHBondContact OD2-CB 3.38Å; D498-M532 HydrophobicContact CB-CE 3.61Å; D498-M532 HydrophobicContact CB-SD 4.03Å; D498-M532 WeakPolarHBondContact OD1-CE 3.41Å | ||
| 499 | E | 85.5 | Confident | 90.1 | Very high | 48 Ų | 48 | 46.2 Ų | 46.2 | 22% | 0.224 | 25% | 0.254 | C | S | . | . | trans | -56.5 | 147.7 | 164.9 | -68.4 | -76.1 | 120.9 | 0 | 0 | 110.4 | S462 C463 H472 L497 S506 | S462-E499 WeakPolarHBondContact CA-OE2 3.4Å; C463-E499 PolarHBondContact N-OE2 2.92Å; H472-E499 PolarHBondContact CE1-O 3.32Å; H472-E499 PolarHBondContact NE2-O 3.47Å; L497-E499 VanDerWaalsContact C-N 3.27Å; L497-E499 PolarHBondContact O-N 2.91Å; E499-S506 WeakPolarHBondContact O-CA 3.39Å | ||
| 500 | V | 91.3 | Very high | 90.2 | Very high | 61 Ų | 61 | 45.8 Ų | 45.8 | 37% | 0.37 | 25% | 0.253 | S | S | . | . | B | Isolated β-bridge | trans | -130.1 | 148 | -179.3 | -65.5 | 0 | 0 | 0 | 0 | 111.8 | C463 N505 M532 | C463-V500 WeakPolarHBondContact CB-O 3.41Å; C463-V500 PolarHBondContact SG-O 3.25Å; V500-N505 WeakPolarHBondContact CA-O 3.22Å; V500-M532 HydrophobicContact CG1-CE 4.44Å |
| 501 | D | 90.8 | Very high | 90.5 | Very high | 28 Ų | 28 | 45.8 Ų | 45.8 | 15% | 0.15 | 25% | 0.253 | C | S | . | . | trans | -80.1 | -175.2 | 174.5 | 74.1 | 12.5 | 0 | 0 | 0 | 113.6 | P468 D503 G504 N505 | P468-D501 HydrophobicContact CB-CB 4.08Å; D501-D503 PolarHBondContact O-N 3.38Å; D501-D503 WeakPolarHBondContact OD1-CA 3.41Å; D501-D503 WeakPolarHBondContact OD1-CB 3.46Å; D501-D503 PolarHBondContact OD1-N 2.99Å; D501-G504 PolarHBondContact O-N 3.46Å; D501-G504 PolarHBondContact OD1-N 2.83Å; D501-G504 VanDerWaalsContact OD1-N 3.16Å; D501-N505 PolarHBondContact N-O 3.43Å; D501-N505 WeakPolarHBondContact OD1-CB 3.32Å; D501-N505 PolarHBondContact OD1-N 2.95Å; D501-N505 PolarHBondContact OD1-ND2 3.42Å; D501-N505 WeakPolarHBondContact OD2-CB 3.48Å; D501-N505 PolarHBondContact OD2-ND2 3.19Å | ||
| 502 | Q | 90.4 | Very high | 90.8 | Very high | 103 Ų | 103 | 40.5 Ų | 40.5 | 48% | 0.481 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.4 | -27 | 179.1 | -73 | 158.9 | 54.2 | 0 | 0 | 114.2 | K465 D466 G504 H535 | K465-Q502 WeakPolarHBondContact O-CG 3.48Å; K465-Q502 PolarHBondContact O-NE2 3.46Å; D466-Q502 PolarHBondContact O-NE2 3.18Å; Q502-G504 VanDerWaalsContact C-N 3.32Å; Q502-H535 PolarHBondContact O-CE1 3.44Å; Q502-H535 PolarHBondContact O-ND1 3.39Å |
| 503 | D | 90.6 | Very high | 91.1 | Very high | 107 Ų | 107 | 36 Ų | 36 | 57% | 0.572 | 21% | 0.207 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -92.5 | 4.9 | 177.5 | -72 | -36.6 | 0 | 0 | 0 | 111.4 | D501 N505 N534 H535 | D501-D503 PolarHBondContact O-N 3.38Å; D501-D503 WeakPolarHBondContact OD1-CA 3.41Å; D501-D503 WeakPolarHBondContact OD1-CB 3.46Å; D501-D503 PolarHBondContact OD1-N 2.99Å; D503-N505 VanDerWaalsContact CB-ND2 3.31Å; D503-N505 WeakPolarHBondContact CB-ND2 3.17Å; D503-N505 PolarHBondContact O-N 3.46Å; D503-N534 WeakPolarHBondContact O-CB 3.1Å; D503-H535 VanDerWaalsContact O-CB 3.28Å; D503-H535 WeakPolarHBondContact O-CB 3.37Å; D503-H535 PolarHBondContact O-N 2.94Å |
| 504 | G | 92.3 | Very high | 91.5 | Very high | 4 Ų | 4 | 34.6 Ų | 34.6 | 4% | 0.041 | 20% | 0.2 | C | C | . | . | S | Bend | trans | 75.3 | 9.8 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | D501 Q502 S506 N534 H535 | D501-G504 PolarHBondContact O-N 3.46Å; D501-G504 PolarHBondContact OD1-N 2.83Å; D501-G504 VanDerWaalsContact OD1-N 3.16Å; Q502-G504 VanDerWaalsContact C-N 3.32Å; G504-S506 PolarHBondContact O-N 2.73Å; G504-N534 WeakPolarHBondContact O-CA 3.35Å; G504-N534 WeakPolarHBondContact O-CB 3.29Å; G504-H535 PolarHBondContact N-CE1 3.04Å; G504-H535 PolarHBondContact N-ND1 3.27Å |
| 505 | N | 93.8 | Very high | 92 | Very high | 5 Ų | 5 | 32.5 Ų | 32.5 | 3% | 0.027 | 18% | 0.179 | C | C | . | . | trans | -76.2 | 124.2 | 177 | -55.1 | -60 | 0 | 0 | 0 | 109.1 | H472 V500 D501 D503 H509 V510 Q513 N534 | H472-N505 PolarHBondContact CD2-O 3.22Å; H472-N505 PolarHBondContact NE2-O 3Å; V500-N505 WeakPolarHBondContact CA-O 3.22Å; D501-N505 PolarHBondContact N-O 3.43Å; D501-N505 WeakPolarHBondContact OD1-CB 3.32Å; D501-N505 PolarHBondContact OD1-N 2.95Å; D501-N505 PolarHBondContact OD1-ND2 3.42Å; D501-N505 WeakPolarHBondContact OD2-CB 3.48Å; D501-N505 PolarHBondContact OD2-ND2 3.19Å; D503-N505 VanDerWaalsContact CB-ND2 3.31Å; D503-N505 WeakPolarHBondContact CB-ND2 3.17Å; D503-N505 PolarHBondContact O-N 3.46Å; N505-H509 HydrophobicContact CB-CB 3.61Å; N505-V510 HydrophobicContact CB-CG2 3.9Å; N505-Q513 PolarHBondContact OD1-NE2 2.95Å; N505-N534 WeakPolarHBondContact OD1-CB 3.29Å; N505-N534 PolarHBondContact OD1-ND2 2.66Å | ||
| 506 | S | 94.2 | Very high | 92.5 | Very high | 1 Ų | 1 | 34.8 Ų | 34.8 | 1% | 0.007 | 19% | 0.185 | C | C | . | . | B | Isolated β-bridge | trans | -76.2 | 169.9 | 162.6 | 65.4 | 0 | 0 | 0 | 0 | 111.9 | E499 G504 V508 H509 V510 M532 | E499-S506 WeakPolarHBondContact O-CA 3.39Å; G504-S506 PolarHBondContact O-N 2.73Å; S506-V508 PolarHBondContact O-N 2.82Å; S506-H509 PolarHBondContact N-ND1 3.23Å; S506-H509 WeakPolarHBondContact O-CA 3.41Å; S506-H509 WeakPolarHBondContact O-CB 3.49Å; S506-H509 PolarHBondContact O-N 3.11Å; S506-H509 PolarHBondContact OG-ND1 3.42Å; S506-V510 PolarHBondContact O-N 3.47Å; S506-M532 VanDerWaalsContact CB-CE 3.49Å |
| 507 | A | 94.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -48.9 | -35.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | I471 H472 V510 A511 L523 | I471-A507 HydrophobicContact CD1-CB 4.04Å; I471-A507 HydrophobicContact CG1-CB 3.9Å; I471-A507 HydrophobicContact CG2-CB 4.11Å; H472-A507 PolarHBondContact CD2-N 3.38Å; H472-A507 PolarHBondContact NE2-N 2.93Å; A507-V510 PolarHBondContact O-N 3.39Å; A507-A511 WeakPolarHBondContact O-CB 3.11Å; A507-A511 PolarHBondContact O-N 3.32Å; A507-L523 HydrophobicContact CB-CD1 4.06Å; A507-L523 HydrophobicContact CB-CD2 3.85Å |
| 508 | V | 95.9 | Very high | 93.7 | Very high | 2 Ų | 2 | 34.2 Ų | 34.2 | 1% | 0.012 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -65.6 | -44.7 | 176.1 | -166 | 0 | 0 | 0 | 0 | 111.3 | S506 S512 I520 L523 A528 V530 P540 L556 | S506-V508 PolarHBondContact O-N 2.82Å; V508-S512 WeakPolarHBondContact O-CB 3.44Å; V508-S512 PolarHBondContact O-N 3.17Å; V508-S512 PolarHBondContact O-OG 2.9Å; V508-I520 HydrophobicContact CG1-CG2 4.39Å; V508-L523 HydrophobicContact CG2-CB 4.14Å; V508-L523 HydrophobicContact CG2-CD1 4.23Å; V508-L523 HydrophobicContact CG2-CD2 4.45Å; V508-A528 HydrophobicContact CG2-CB 3.66Å; V508-V530 HydrophobicContact CG1-CG1 4.29Å; V508-P540 HydrophobicContact CB-CB 4.32Å; V508-P540 HydrophobicContact CB-CG 4.09Å; V508-P540 HydrophobicContact CG1-CB 3.76Å; V508-P540 HydrophobicContact CG1-CG 3.91Å; V508-L556 HydrophobicContact CG1-CD2 3.97Å |
| 509 | H | 96.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -60.8 | -45.7 | 175.5 | -69.5 | 87.7 | 0 | 0 | 0 | 110.9 | N505 S506 S512 Q513 M532 E538 P540 | N505-H509 HydrophobicContact CB-CB 3.61Å; S506-H509 PolarHBondContact N-ND1 3.23Å; S506-H509 WeakPolarHBondContact O-CA 3.41Å; S506-H509 WeakPolarHBondContact O-CB 3.49Å; S506-H509 PolarHBondContact O-N 3.11Å; S506-H509 PolarHBondContact OG-ND1 3.42Å; H509-S512 WeakPolarHBondContact O-CB 3.11Å; H509-S512 PolarHBondContact O-N 3.26Å; H509-Q513 VanDerWaalsContact O-CG 3.29Å; H509-Q513 WeakPolarHBondContact O-CG 3.37Å; H509-Q513 PolarHBondContact O-N 3.24Å; H509-M532 PolarHBondContact CE1-O 3.45Å; H509-M532 PolarHBondContact NE2-O 3.15Å; H509-E538 PolarHBondContact NE2-O 3.46Å; H509-E538 VanDerWaalsContact NE2-O 3.08Å; H509-P540 WeakPolarHBondContact NE2-CD 3.44Å |
| 510 | V | 95.7 | Very high | 94.9 | Very high | 11 Ų | 11 | 29.4 Ų | 29.4 | 7% | 0.067 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -64.3 | -45.5 | -179.3 | -179 | 0 | 0 | 0 | 0 | 111.5 | C476 N505 S506 A507 S512 Q513 H514 | C476-V510 HydrophobicContact CB-CG1 3.69Å; N505-V510 HydrophobicContact CB-CG2 3.9Å; S506-V510 PolarHBondContact O-N 3.47Å; A507-V510 PolarHBondContact O-N 3.39Å; V510-S512 VanDerWaalsContact C-N 3.29Å; V510-S512 PolarHBondContact O-N 3.45Å; V510-Q513 PolarHBondContact O-N 3.16Å; V510-H514 PolarHBondContact O-N 3.47Å; V510-H514 PolarHBondContact O-ND1 3.16Å |
| 511 | A | 96.7 | Very high | 95.1 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -64.1 | -33.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A507 G515 Y516 C519 I520 L523 | A507-A511 WeakPolarHBondContact O-CB 3.11Å; A507-A511 PolarHBondContact O-N 3.32Å; A511-G515 PolarHBondContact O-N 2.89Å; A511-Y516 PolarHBondContact O-N 3.36Å; A511-C519 HydrophobicContact CB-CB 4.03Å; A511-I520 HydrophobicContact CB-CG1 3.75Å; A511-L523 HydrophobicContact CB-CD1 4.33Å |
| 512 | S | 97 | Very high | 95.4 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -67.4 | -41.1 | 175.5 | -63.2 | 0 | 0 | 0 | 0 | 112.8 | V508 H509 V510 H514 G515 P540 A544 H549 L556 | V508-S512 WeakPolarHBondContact O-CB 3.44Å; V508-S512 PolarHBondContact O-N 3.17Å; V508-S512 PolarHBondContact O-OG 2.9Å; H509-S512 WeakPolarHBondContact O-CB 3.11Å; H509-S512 PolarHBondContact O-N 3.26Å; V510-S512 VanDerWaalsContact C-N 3.29Å; V510-S512 PolarHBondContact O-N 3.45Å; S512-H514 PolarHBondContact O-N 3.33Å; S512-G515 PolarHBondContact O-N 2.94Å; S512-P540 VanDerWaalsContact CB-O 3.31Å; S512-P540 WeakPolarHBondContact CB-O 3.46Å; S512-A544 WeakPolarHBondContact O-CA 3.44Å; S512-H549 PolarHBondContact O-CD2 3.43Å; S512-L556 VanDerWaalsContact OG-CD1 3.22Å; S512-L556 WeakPolarHBondContact OG-CD1 3.4Å |
| 513 | Q | 96.5 | Very high | 95.6 | Very high | 32 Ų | 32 | 24.4 Ų | 24.4 | 15% | 0.15 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -68.4 | -17.6 | 179.7 | -74.7 | 175.8 | 26 | 0 | 0 | 114.2 | N505 H509 V510 Q547 H549 | N505-Q513 PolarHBondContact OD1-NE2 2.95Å; H509-Q513 VanDerWaalsContact O-CG 3.29Å; H509-Q513 WeakPolarHBondContact O-CG 3.37Å; H509-Q513 PolarHBondContact O-N 3.24Å; V510-Q513 PolarHBondContact O-N 3.16Å; Q513-Q547 HydrophobicContact CB-CG 4.19Å; Q513-Q547 HydrophobicContact CG-CG 4.28Å; Q513-Q547 WeakPolarHBondContact O-CG 3.16Å; Q513-H549 PolarHBondContact O-NE2 2.98Å |
| 514 | H | 95.9 | Very high | 95.8 | Very high | 79 Ų | 79 | 20.9 Ų | 20.9 | 37% | 0.366 | 11% | 0.112 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -113.1 | -1.1 | 177.6 | -59.6 | 87.7 | 0 | 0 | 0 | 113.3 | V510 S512 Y516 H549 | V510-H514 PolarHBondContact O-N 3.47Å; V510-H514 PolarHBondContact O-ND1 3.16Å; S512-H514 PolarHBondContact O-N 3.33Å; H514-Y516 HydrophobicContact CB-CD2 3.55Å; H514-Y516 HydrophobicContact CB-CE2 3.28Å; H514-H549 VanDerWaalsContact C-NE2 3.26Å |
| 515 | G | 96.3 | Very high | 95.9 | Very high | 23 Ų | 23 | 27.2 Ų | 27.2 | 24% | 0.237 | 14% | 0.141 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 79.5 | 17 | 171.8 | 0 | 0 | 0 | 0 | 0 | 116.5 | A511 S512 L517 H549 C552 | A511-G515 PolarHBondContact O-N 2.89Å; S512-G515 PolarHBondContact O-N 2.94Å; G515-L517 PolarHBondContact O-N 2.75Å; G515-H549 PolarHBondContact N-CD2 3.48Å; G515-H549 VanDerWaalsContact N-CD2 3.27Å; G515-H549 PolarHBondContact N-NE2 3.17Å; G515-C552 PolarHBondContact O-SG 3.44Å |
| 516 | Y | 97.3 | Very high | 95.8 | Very high | 89 Ų | 89 | 29 Ų | 29 | 35% | 0.349 | 15% | 0.147 | S | C | . | . | trans | -81 | 78.4 | -176.5 | -60.8 | -66.7 | 0 | 0 | 0 | 112.5 | G475 C476 G478 A511 H514 G518 C519 I520 | G475-Y516 WeakPolarHBondContact O-CD2 3.18Å; C476-Y516 VanDerWaalsContact O-CE2 3.26Å; C476-Y516 WeakPolarHBondContact O-CE2 3.32Å; G478-Y516 VanDerWaalsContact CA-CD1 3.44Å; A511-Y516 PolarHBondContact O-N 3.36Å; H514-Y516 HydrophobicContact CB-CD2 3.55Å; H514-Y516 HydrophobicContact CB-CE2 3.28Å; Y516-G518 VanDerWaalsContact C-N 3.29Å; Y516-G518 PolarHBondContact O-N 3.03Å; Y516-C519 WeakPolarHBondContact O-CB 3.27Å; Y516-C519 PolarHBondContact O-N 3.06Å; Y516-I520 WeakPolarHBondContact O-CG1 3.36Å; Y516-I520 PolarHBondContact O-N 2.78Å; Y516-I520 VanDerWaalsContact O-N 3.07Å | ||
| 517 | L | 96.5 | Very high | 95.7 | Very high | 53 Ų | 53 | 31.5 Ų | 31.5 | 28% | 0.277 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -52.7 | -39.7 | -176.7 | -176.8 | 60.4 | 0 | 0 | 0 | 114.1 | G515 I520 Q521 Y555 | G515-L517 PolarHBondContact O-N 2.75Å; L517-I520 PolarHBondContact O-N 3.01Å; L517-Q521 HydrophobicContact CD1-CG 4.32Å; L517-Q521 HydrophobicContact CG-CG 4.42Å; L517-Q521 WeakPolarHBondContact O-CB 3.38Å; L517-Q521 VanDerWaalsContact O-CG 3.31Å; L517-Q521 WeakPolarHBondContact O-CG 3.36Å; L517-Q521 PolarHBondContact O-N 2.86Å; L517-Y555 HydrophobicContact CD1-CD1 3.84Å; L517-Y555 HydrophobicContact CD1-CD2 4.42Å; L517-Y555 HydrophobicContact CD1-CG 3.74Å |
| 518 | G | 96.7 | Very high | 95.6 | Very high | 17 Ų | 17 | 31.8 Ų | 31.8 | 18% | 0.175 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.5 | -38.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | E480 Y516 Q521 T522 | E480-G518 VanDerWaalsContact OE2-CA 3.31Å; E480-G518 WeakPolarHBondContact OE2-CA 3.46Å; Y516-G518 VanDerWaalsContact C-N 3.29Å; Y516-G518 PolarHBondContact O-N 3.03Å; G518-Q521 PolarHBondContact O-N 3.36Å; G518-T522 WeakPolarHBondContact O-CB 3.19Å; G518-T522 PolarHBondContact O-N 2.85Å; G518-T522 PolarHBondContact O-OG1 2.85Å |
| 519 | C | 97 | Very high | 95.3 | Very high | 2 Ų | 2 | 34.3 Ų | 34.3 | 1% | 0.014 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.9 | -42.9 | 171.1 | -68.1 | 0 | 0 | 0 | 0 | 111.8 | L483 A511 Y516 T522 L523 | L483-C519 HydrophobicContact CD2-CB 3.45Å; L483-C519 VanDerWaalsContact CD2-CB 3.45Å; A511-C519 HydrophobicContact CB-CB 4.03Å; Y516-C519 WeakPolarHBondContact O-CB 3.27Å; Y516-C519 PolarHBondContact O-N 3.06Å; C519-T522 PolarHBondContact O-N 2.91Å; C519-L523 WeakPolarHBondContact O-CB 3.32Å; C519-L523 WeakPolarHBondContact O-CD1 3.45Å; C519-L523 WeakPolarHBondContact O-CG 3.19Å; C519-L523 PolarHBondContact O-N 3.42Å |
| 520 | I | 96.9 | Very high | 95.2 | Very high | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.4 | -43.1 | 178.1 | -60.3 | 166.3 | 0 | 0 | 0 | 110.7 | V508 A511 Y516 L517 L523 V524 C552 Y555 L556 | V508-I520 HydrophobicContact CG1-CG2 4.39Å; A511-I520 HydrophobicContact CB-CG1 3.75Å; Y516-I520 WeakPolarHBondContact O-CG1 3.36Å; Y516-I520 PolarHBondContact O-N 2.78Å; Y516-I520 VanDerWaalsContact O-N 3.07Å; L517-I520 PolarHBondContact O-N 3.01Å; I520-L523 PolarHBondContact O-N 3.47Å; I520-V524 WeakPolarHBondContact O-CB 3.41Å; I520-V524 VanDerWaalsContact O-CG2 3.31Å; I520-V524 WeakPolarHBondContact O-CG2 3.36Å; I520-V524 PolarHBondContact O-N 2.99Å; I520-C552 HydrophobicContact CD1-CB 3.64Å; I520-Y555 HydrophobicContact CG2-CD1 3.97Å; I520-Y555 HydrophobicContact CG2-CE1 4Å; I520-L556 HydrophobicContact CD1-CD1 4.44Å; I520-L556 HydrophobicContact CG2-CD1 4.17Å; I520-L556 HydrophobicContact CG2-CD2 3.64Å; I520-L556 HydrophobicContact CG2-CG 3.91Å |
| 521 | Q | 96.5 | Very high | 95 | Very high | 74 Ų | 74 | 37.5 Ų | 37.5 | 35% | 0.346 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -60 | -47 | 174.4 | -76.6 | 171.1 | -17.8 | 0 | 0 | 111.3 | L517 G518 L523 V524 E525 Y555 | L517-Q521 HydrophobicContact CD1-CG 4.32Å; L517-Q521 HydrophobicContact CG-CG 4.42Å; L517-Q521 WeakPolarHBondContact O-CB 3.38Å; L517-Q521 VanDerWaalsContact O-CG 3.31Å; L517-Q521 WeakPolarHBondContact O-CG 3.36Å; L517-Q521 PolarHBondContact O-N 2.86Å; G518-Q521 PolarHBondContact O-N 3.36Å; Q521-L523 PolarHBondContact O-N 3.26Å; Q521-V524 PolarHBondContact O-N 3.48Å; Q521-E525 WeakPolarHBondContact O-CG 3.42Å; Q521-E525 PolarHBondContact O-N 2.81Å; Q521-Y555 HydrophobicContact CG-CD1 4.49Å; Q521-Y555 HydrophobicContact CG-CE1 3.84Å; Q521-Y555 HydrophobicContact CG-CE2 3.95Å |
| 522 | T | 96.4 | Very high | 94.8 | Very high | 14 Ų | 14 | 39.4 Ų | 39.4 | 9% | 0.086 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.1 | -43.4 | 177.7 | -53.7 | 0 | 0 | 0 | 0 | 111.9 | E480 L484 L487 G518 C519 E525 Y526 | E480-T522 WeakPolarHBondContact CG-OG1 3.47Å; L484-T522 HydrophobicContact CB-CG2 3.98Å; L484-T522 HydrophobicContact CD1-CG2 3.98Å; L487-T522 HydrophobicContact CD1-CG2 3.79Å; G518-T522 WeakPolarHBondContact O-CB 3.19Å; G518-T522 PolarHBondContact O-N 2.85Å; G518-T522 PolarHBondContact O-OG1 2.85Å; C519-T522 PolarHBondContact O-N 2.91Å; T522-E525 PolarHBondContact O-N 3.42Å; T522-Y526 HydrophobicContact CG2-CD2 4.48Å; T522-Y526 WeakPolarHBondContact O-CD2 3.3Å; T522-Y526 PolarHBondContact O-N 3.08Å; T522-Y526 VanDerWaalsContact O-N 3.15Å |
| 523 | L | 95.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.9 | -42.4 | 175.4 | -81.2 | 158.4 | 0 | 0 | 0 | 112.3 | I471 L483 L487 A507 V508 A511 C519 I520 Q521 Y526 G527 A528 | I471-L523 HydrophobicContact CD1-CD2 4.14Å; L483-L523 HydrophobicContact CD1-CD2 4.25Å; L483-L523 HydrophobicContact CD1-CG 4.33Å; L483-L523 HydrophobicContact CD2-CD1 4.03Å; L483-L523 HydrophobicContact CD2-CG 4.07Å; L487-L523 HydrophobicContact CD1-CD2 4.26Å; L487-L523 HydrophobicContact CD1-CG 4.43Å; L487-L523 HydrophobicContact CD2-CD2 4.07Å; A507-L523 HydrophobicContact CB-CD1 4.06Å; A507-L523 HydrophobicContact CB-CD2 3.85Å; V508-L523 HydrophobicContact CG2-CB 4.14Å; V508-L523 HydrophobicContact CG2-CD1 4.23Å; V508-L523 HydrophobicContact CG2-CD2 4.45Å; A511-L523 HydrophobicContact CB-CD1 4.33Å; C519-L523 WeakPolarHBondContact O-CB 3.32Å; C519-L523 WeakPolarHBondContact O-CD1 3.45Å; C519-L523 WeakPolarHBondContact O-CG 3.19Å; C519-L523 PolarHBondContact O-N 3.42Å; I520-L523 PolarHBondContact O-N 3.47Å; Q521-L523 PolarHBondContact O-N 3.26Å; L523-Y526 CarbonylContact O-C 3.58Å; L523-Y526 PolarHBondContact O-N 2.88Å; L523-G527 PolarHBondContact O-N 3.37Å; L523-A528 HydrophobicContact CB-CB 4.07Å; L523-A528 HydrophobicContact CD2-CB 3.99Å; L523-A528 VanDerWaalsContact O-CB 3.3Å; L523-A528 WeakPolarHBondContact O-CB 3.35Å; L523-A528 PolarHBondContact O-N 3.11Å |
| 524 | V | 94.7 | Very high | 94.6 | Very high | 32 Ų | 32 | 44.4 Ų | 44.4 | 19% | 0.194 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -66.7 | -39.5 | 176.4 | 167.8 | 0 | 0 | 0 | 0 | 111.9 | I520 Q521 Y526 G527 V530 Y555 V559 | I520-V524 WeakPolarHBondContact O-CB 3.41Å; I520-V524 VanDerWaalsContact O-CG2 3.31Å; I520-V524 WeakPolarHBondContact O-CG2 3.36Å; I520-V524 PolarHBondContact O-N 2.99Å; Q521-V524 PolarHBondContact O-N 3.48Å; V524-Y526 VanDerWaalsContact C-N 3.27Å; V524-Y526 PolarHBondContact O-N 2.79Å; V524-G527 PolarHBondContact O-N 3.28Å; V524-V530 HydrophobicContact CG2-CG1 3.56Å; V524-Y555 HydrophobicContact CG2-CE1 4.21Å; V524-V559 HydrophobicContact CG1-CG1 3.65Å; V524-V559 HydrophobicContact CG1-CG2 4.06Å; V524-V559 HydrophobicContact CG2-CG1 4.09Å |
| 525 | E | 93.9 | Very high | 94.6 | Very high | 138 Ų | 138 | 47.6 Ų | 47.6 | 65% | 0.645 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -63 | -32.7 | 175.8 | -77.6 | -172.4 | -168.8 | 0 | 0 | 112.9 | Q521 T522 G527 | Q521-E525 WeakPolarHBondContact O-CG 3.42Å; Q521-E525 PolarHBondContact O-N 2.81Å; T522-E525 PolarHBondContact O-N 3.42Å; E525-G527 VanDerWaalsContact C-N 3.31Å |
| 526 | Y | 92.9 | Very high | 94.5 | Very high | 43 Ų | 43 | 50.2 Ų | 50.2 | 17% | 0.169 | 28% | 0.275 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.5 | 4.7 | 173.5 | -80.9 | -103.7 | 0 | 0 | 0 | 113.5 | L484 L487 Q488 L497 T522 L523 V524 | L484-Y526 HydrophobicContact CD1-CD2 4.5Å; L484-Y526 HydrophobicContact CD1-CE2 3.48Å; L484-Y526 VanDerWaalsContact CD1-CE2 3.48Å; L487-Y526 HydrophobicContact CB-CD1 3.76Å; L487-Y526 HydrophobicContact CB-CD2 4.35Å; L487-Y526 HydrophobicContact CB-CE1 4.14Å; L487-Y526 HydrophobicContact CB-CG 3.88Å; L487-Y526 HydrophobicContact CD1-CD2 4.23Å; L487-Y526 HydrophobicContact CD1-CG 4.17Å; L487-Y526 HydrophobicContact CG-CG 4.44Å; Q488-Y526 HydrophobicContact CB-CE1 4.4Å; Q488-Y526 PolarHBondContact OE1-OH 3.1Å; L497-Y526 VanDerWaalsContact CD1-O 3.31Å; L497-Y526 WeakPolarHBondContact CD1-O 3.38Å; T522-Y526 HydrophobicContact CG2-CD2 4.48Å; T522-Y526 WeakPolarHBondContact O-CD2 3.3Å; T522-Y526 PolarHBondContact O-N 3.08Å; T522-Y526 VanDerWaalsContact O-N 3.15Å; L523-Y526 CarbonylContact O-C 3.58Å; L523-Y526 PolarHBondContact O-N 2.88Å; V524-Y526 VanDerWaalsContact C-N 3.27Å; V524-Y526 PolarHBondContact O-N 2.79Å |
| 527 | G | 90.1 | Very high | 94.4 | Very high | 52 Ų | 52 | 47.7 Ų | 47.7 | 54% | 0.536 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.4 | 13.7 | 169.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | L523 V524 E525 | L523-G527 PolarHBondContact O-N 3.37Å; V524-G527 PolarHBondContact O-N 3.28Å; E525-G527 VanDerWaalsContact C-N 3.31Å |
| 528 | A | 92.6 | Very high | 94.3 | Very high | 7 Ų | 7 | 46.9 Ų | 46.9 | 6% | 0.058 | 27% | 0.271 | C | S | . | . | trans | -59.1 | 141.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | V508 L523 V530 | V508-A528 HydrophobicContact CG2-CB 3.66Å; L523-A528 HydrophobicContact CB-CB 4.07Å; L523-A528 HydrophobicContact CD2-CB 3.99Å; L523-A528 VanDerWaalsContact O-CB 3.3Å; L523-A528 WeakPolarHBondContact O-CB 3.35Å; L523-A528 PolarHBondContact O-N 3.11Å; A528-V530 PolarHBondContact O-N 3.07Å | ||
| 529 | N | 91.2 | Very high | 94.3 | Very high | 55 Ų | 55 | 48.9 Ų | 48.9 | 29% | 0.294 | 28% | 0.275 | S | S | . | . | trans | -80.4 | 95.2 | -166.9 | -175.8 | -2.7 | 0 | 0 | 0 | 113.2 | D498 T531 M532 | D498-N529 WeakPolarHBondContact OD1-CB 3.36Å; D498-N529 PolarHBondContact OD1-N 2.97Å; D498-N529 WeakPolarHBondContact OD2-CB 3.38Å; N529-T531 PolarHBondContact O-N 2.95Å; N529-T531 VanDerWaalsContact O-N 3.09Å; N529-T531 WeakPolarHBondContact OD1-CB 3.23Å; N529-T531 PolarHBondContact OD1-N 3.38Å; N529-T531 PolarHBondContact OD1-OG1 3.46Å; N529-M532 HydrophobicContact CB-CE 4.23Å; N529-M532 HydrophobicContact CB-CG 3.87Å; N529-M532 HydrophobicContact CB-SD 4.32Å; N529-M532 VanDerWaalsContact ND2-CG 3.34Å; N529-M532 WeakPolarHBondContact ND2-CG 3.26Å; N529-M532 PolarHBondContact O-N 3.45Å | ||
| 530 | V | 93.1 | Very high | 94.3 | Very high | 6 Ų | 6 | 48.8 Ų | 48.8 | 4% | 0.036 | 27% | 0.274 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -6.6 | 174.9 | -60.1 | 0 | 0 | 0 | 0 | 115.2 | V508 V524 A528 P540 L556 V559 E560 | V508-V530 HydrophobicContact CG1-CG1 4.29Å; V524-V530 HydrophobicContact CG2-CG1 3.56Å; A528-V530 PolarHBondContact O-N 3.07Å; V530-P540 WeakPolarHBondContact O-CD 3.3Å; V530-L556 HydrophobicContact CB-CD2 4.16Å; V530-L556 HydrophobicContact CG1-CD2 3.69Å; V530-V559 HydrophobicContact CG1-CG1 4.2Å; V530-V559 HydrophobicContact CG2-CG1 4.02Å; V530-E560 HydrophobicContact CB-CG 4.33Å; V530-E560 HydrophobicContact CG2-CG 3.8Å |
| 531 | T | 92.3 | Very high | 94.3 | Very high | 71 Ų | 71 | 49 Ų | 49 | 44% | 0.436 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102.4 | -7.5 | -176.5 | 70.9 | 0 | 0 | 0 | 0 | 114.7 | N529 E560 | N529-T531 PolarHBondContact O-N 2.95Å; N529-T531 VanDerWaalsContact O-N 3.09Å; N529-T531 WeakPolarHBondContact OD1-CB 3.23Å; N529-T531 PolarHBondContact OD1-N 3.38Å; N529-T531 PolarHBondContact OD1-OG1 3.46Å; T531-E560 HydrophobicContact CG2-CG 4.38Å |
| 532 | M | 92.1 | Very high | 94.3 | Very high | 41 Ų | 41 | 49.6 Ų | 49.6 | 20% | 0.202 | 28% | 0.279 | C | S | . | . | trans | -59.8 | 155.5 | 174.1 | -63.3 | -160.6 | -69.3 | 0 | 0 | 111.5 | D498 V500 S506 H509 N529 | D498-M532 HydrophobicContact CB-CE 3.61Å; D498-M532 HydrophobicContact CB-SD 4.03Å; D498-M532 WeakPolarHBondContact OD1-CE 3.41Å; V500-M532 HydrophobicContact CG1-CE 4.44Å; S506-M532 VanDerWaalsContact CB-CE 3.49Å; H509-M532 PolarHBondContact CE1-O 3.45Å; H509-M532 PolarHBondContact NE2-O 3.15Å; N529-M532 HydrophobicContact CB-CE 4.23Å; N529-M532 HydrophobicContact CB-CG 3.87Å; N529-M532 HydrophobicContact CB-SD 4.32Å; N529-M532 VanDerWaalsContact ND2-CG 3.34Å; N529-M532 WeakPolarHBondContact ND2-CG 3.26Å; N529-M532 PolarHBondContact O-N 3.45Å | ||
| 533 | Q | 95 | Very high | 94.3 | Very high | 124 Ų | 124 | 49 Ų | 49 | 58% | 0.579 | 28% | 0.275 | S | S | * | . | trans | -118 | 138.1 | 174 | -69.1 | 179 | -48.9 | 0 | 0 | 110 | G537 E538 K539 | Q533-G537 PolarHBondContact NE2-O 3.37Å; Q533-E538 VanDerWaalsContact CA-O 3.27Å; Q533-E538 WeakPolarHBondContact CA-O 3.37Å; Q533-K539 HydrophobicContact CG-CG 4.03Å | ||
| 534 | N | 94.8 | Very high | 94.4 | Very high | 13 Ų | 13 | 49 Ų | 49 | 7% | 0.07 | 28% | 0.275 | C | S | . | . | trans | -77 | -179.1 | 172.5 | 71 | 7.6 | 0 | 0 | 0 | 112.1 | D503 G504 N505 A536 G537 E538 | D503-N534 WeakPolarHBondContact O-CB 3.1Å; G504-N534 WeakPolarHBondContact O-CA 3.35Å; G504-N534 WeakPolarHBondContact O-CB 3.29Å; N505-N534 WeakPolarHBondContact OD1-CB 3.29Å; N505-N534 PolarHBondContact OD1-ND2 2.66Å; N534-A536 PolarHBondContact O-N 2.86Å; N534-A536 VanDerWaalsContact O-N 3.1Å; N534-A536 WeakPolarHBondContact OD1-CA 3.4Å; N534-A536 WeakPolarHBondContact OD1-CB 3.3Å; N534-A536 PolarHBondContact OD1-N 2.71Å; N534-G537 PolarHBondContact O-N 3.25Å; N534-G537 PolarHBondContact OD1-N 2.9Å; N534-E538 PolarHBondContact N-O 2.97Å; N534-E538 WeakPolarHBondContact OD1-CB 3.28Å; N534-E538 PolarHBondContact OD1-N 2.91Å; N534-E538 PolarHBondContact OD1-O 3.15Å | ||
| 535 | H | 95.2 | Very high | 94.4 | Very high | 146 Ų | 146 | 53.6 Ų | 53.6 | 68% | 0.676 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65 | -12.5 | -180 | -64.4 | 154.5 | 0 | 0 | 0 | 114.2 | Q502 D503 G504 | Q502-H535 PolarHBondContact O-CE1 3.44Å; Q502-H535 PolarHBondContact O-ND1 3.39Å; D503-H535 VanDerWaalsContact O-CB 3.28Å; D503-H535 WeakPolarHBondContact O-CB 3.37Å; D503-H535 PolarHBondContact O-N 2.94Å; G504-H535 PolarHBondContact N-CE1 3.04Å; G504-H535 PolarHBondContact N-ND1 3.27Å |
| 536 | A | 93.9 | Very high | 94.5 | Very high | 77 Ų | 77 | 52.8 Ų | 52.8 | 64% | 0.636 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.9 | -1.8 | 169.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | N534 E538 | N534-A536 PolarHBondContact O-N 2.86Å; N534-A536 VanDerWaalsContact O-N 3.1Å; N534-A536 WeakPolarHBondContact OD1-CA 3.4Å; N534-A536 WeakPolarHBondContact OD1-CB 3.3Å; N534-A536 PolarHBondContact OD1-N 2.71Å; A536-E538 VanDerWaalsContact C-N 3.26Å; A536-E538 HydrophobicContact CB-CG 4.12Å; A536-E538 PolarHBondContact O-N 3.14Å |
| 537 | G | 95.3 | Very high | 94.7 | Very high | 36 Ų | 36 | 55 Ų | 55 | 37% | 0.371 | 30% | 0.297 | S | S | . | . | S | Bend | trans | 77.6 | 7.2 | -174.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q533 N534 | Q533-G537 PolarHBondContact NE2-O 3.37Å; N534-G537 PolarHBondContact O-N 3.25Å; N534-G537 PolarHBondContact OD1-N 2.9Å |
| 538 | E | 95.5 | Very high | 95 | Very high | 36 Ų | 36 | 54.9 Ų | 54.9 | 17% | 0.168 | 30% | 0.296 | C | S | . | . | trans | -84.4 | 139 | -179.8 | -58.8 | -177.7 | 162.2 | 0 | 0 | 111 | H509 Q533 N534 A536 Q542 S543 R546 | H509-E538 PolarHBondContact NE2-O 3.46Å; H509-E538 VanDerWaalsContact NE2-O 3.08Å; Q533-E538 VanDerWaalsContact CA-O 3.27Å; Q533-E538 WeakPolarHBondContact CA-O 3.37Å; N534-E538 PolarHBondContact N-O 2.97Å; N534-E538 WeakPolarHBondContact OD1-CB 3.28Å; N534-E538 PolarHBondContact OD1-N 2.91Å; N534-E538 PolarHBondContact OD1-O 3.15Å; A536-E538 VanDerWaalsContact C-N 3.26Å; A536-E538 HydrophobicContact CB-CG 4.12Å; A536-E538 PolarHBondContact O-N 3.14Å; E538-Q542 HydrophobicContact CB-CB 4.27Å; E538-S543 WeakPolarHBondContact CB-OG 3.43Å; E538-S543 WeakPolarHBondContact OE2-CB 3.38Å; E538-S543 PolarHBondContact OE2-OG 3.22Å; E538-R546 VanDerWaalsContact CD-NE 3.32Å; E538-R546 VanDerWaalsContact OE1-CD 3.3Å; E538-R546 WeakPolarHBondContact OE1-CD 3.3Å; E538-R546 IonicContact OE1-CZ 2.74Å; E538-R546 IonicContact OE1-NE 2.65Å; E538-R546 PolarHBondContact OE1-NE 3.17Å; E538-R546 IonicContact OE1-NH2 3.96Å; E538-R546 IonicContact OE2-CZ 2.68Å; E538-R546 IonicContact OE2-NE 3.24Å; E538-R546 PolarHBondContact OE2-NE 3.39Å; E538-R546 VanDerWaalsContact OE2-NE 3.12Å; E538-R546 IonicContact OE2-NH2 2.96Å; E538-R546 PolarHBondContact OE2-NH2 3.35Å | ||
| 539 | K | 95.8 | Very high | 95.2 | Very high | 59 Ų | 59 | 57.5 Ų | 57.5 | 26% | 0.257 | 31% | 0.307 | S | S | . | . | trans | -78 | 163.5 | 161.1 | -70.5 | -177.9 | 170.1 | -176.8 | 0 | 111.6 | Q533 S541 Q542 S543 E560 | Q533-K539 HydrophobicContact CG-CG 4.03Å; K539-S541 WeakPolarHBondContact CB-OG 3.4Å; K539-S541 PolarHBondContact O-N 3.25Å; K539-Q542 HydrophobicContact CB-CG 4.38Å; K539-Q542 WeakPolarHBondContact O-CB 3.27Å; K539-Q542 PolarHBondContact O-N 3.12Å; K539-S543 PolarHBondContact O-N 2.7Å; K539-S543 PolarHBondContact O-OG 2.99Å; K539-E560 VanDerWaalsContact CD-OE2 3.3Å; K539-E560 WeakPolarHBondContact CD-OE2 3.22Å; K539-E560 WeakPolarHBondContact CE-OE2 3.48Å; K539-E560 IonicContact NZ-OE2 2.73Å; K539-E560 PolarHBondContact NZ-OE2 3.22Å | ||
| 540 | P | 96.3 | Very high | 95.4 | Very high | 0 Ų | 0 | 59.1 Ų | 59.1 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -54.8 | -38 | 173.7 | -22.7 | 31.9 | 0 | 0 | 0 | 113.4 | V508 H509 S512 V530 Q542 S543 A544 L556 | V508-P540 HydrophobicContact CB-CB 4.32Å; V508-P540 HydrophobicContact CB-CG 4.09Å; V508-P540 HydrophobicContact CG1-CB 3.76Å; V508-P540 HydrophobicContact CG1-CG 3.91Å; H509-P540 WeakPolarHBondContact NE2-CD 3.44Å; S512-P540 VanDerWaalsContact CB-O 3.31Å; S512-P540 WeakPolarHBondContact CB-O 3.46Å; V530-P540 WeakPolarHBondContact O-CD 3.3Å; P540-Q542 VanDerWaalsContact C-N 3.31Å; P540-Q542 PolarHBondContact O-N 2.98Å; P540-S543 PolarHBondContact O-N 3.07Å; P540-A544 WeakPolarHBondContact O-CB 3.43Å; P540-A544 PolarHBondContact O-N 3.08Å; P540-L556 HydrophobicContact CB-CD1 4.02Å; P540-L556 HydrophobicContact CB-CD2 4.36Å |
| 541 | S | 96.9 | Very high | 95.6 | Very high | 5 Ų | 5 | 64.7 Ų | 64.7 | 4% | 0.035 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.4 | -37.4 | 175.8 | 45.3 | 0 | 0 | 0 | 0 | 113.2 | K539 E545 S553 E560 | K539-S541 WeakPolarHBondContact CB-OG 3.4Å; K539-S541 PolarHBondContact O-N 3.25Å; S541-E545 PolarHBondContact O-N 3.27Å; S541-S553 VanDerWaalsContact O-CB 3.26Å; S541-S553 WeakPolarHBondContact O-CB 3.36Å; S541-S553 PolarHBondContact O-OG 2.94Å; S541-E560 VanDerWaalsContact CB-OE1 3.25Å; S541-E560 WeakPolarHBondContact CB-OE1 3.49Å; S541-E560 PolarHBondContact OG-OE1 3.35Å |
| 542 | Q | 96.6 | Very high | 95.9 | Very high | 87 Ų | 87 | 61.5 Ų | 61.5 | 41% | 0.407 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -80.9 | -39.6 | 179.1 | -63.8 | 171.5 | -47.4 | 0 | 0 | 111.3 | E538 K539 P540 A544 E545 R546 | E538-Q542 HydrophobicContact CB-CB 4.27Å; K539-Q542 HydrophobicContact CB-CG 4.38Å; K539-Q542 WeakPolarHBondContact O-CB 3.27Å; K539-Q542 PolarHBondContact O-N 3.12Å; P540-Q542 VanDerWaalsContact C-N 3.31Å; P540-Q542 PolarHBondContact O-N 2.98Å; Q542-A544 VanDerWaalsContact C-N 3.31Å; Q542-A544 PolarHBondContact O-N 2.94Å; Q542-E545 PolarHBondContact O-N 2.74Å; Q542-E545 VanDerWaalsContact O-N 3.14Å; Q542-R546 PolarHBondContact O-N 3.39Å |
| 543 | S | 96.2 | Very high | 96.1 | Very high | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.6 | -35.8 | 172.2 | -58.3 | 0 | 0 | 0 | 0 | 112.1 | E538 K539 P540 Q547 | E538-S543 WeakPolarHBondContact CB-OG 3.43Å; E538-S543 WeakPolarHBondContact OE2-CB 3.38Å; E538-S543 PolarHBondContact OE2-OG 3.22Å; K539-S543 PolarHBondContact O-N 2.7Å; K539-S543 PolarHBondContact O-OG 2.99Å; P540-S543 PolarHBondContact O-N 3.07Å; S543-Q547 WeakPolarHBondContact O-CG 3.28Å; S543-Q547 PolarHBondContact O-N 3.19Å |
| 544 | A | 97.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | S512 P540 Q542 Q547 G548 H549 C552 | S512-A544 WeakPolarHBondContact O-CA 3.44Å; P540-A544 WeakPolarHBondContact O-CB 3.43Å; P540-A544 PolarHBondContact O-N 3.08Å; Q542-A544 VanDerWaalsContact C-N 3.31Å; Q542-A544 PolarHBondContact O-N 2.94Å; A544-Q547 PolarHBondContact O-N 3.3Å; A544-G548 PolarHBondContact O-N 3.2Å; A544-H549 HydrophobicContact CB-CB 4.3Å; A544-H549 WeakPolarHBondContact O-CA 3.35Å; A544-H549 PolarHBondContact O-N 2.85Å; A544-C552 HydrophobicContact CB-CB 3.98Å |
| 545 | E | 96.7 | Very high | 96.3 | Very high | 130 Ų | 130 | 65.3 Ų | 65.3 | 61% | 0.607 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -63.8 | -46.4 | 179 | -172 | 172.7 | -161 | 0 | 0 | 111.9 | S541 Q542 Q547 G548 | S541-E545 PolarHBondContact O-N 3.27Å; Q542-E545 PolarHBondContact O-N 2.74Å; Q542-E545 VanDerWaalsContact O-N 3.14Å; E545-Q547 PolarHBondContact O-N 2.89Å; E545-G548 PolarHBondContact O-N 3.32Å |
| 546 | R | 95.8 | Very high | 96.4 | Very high | 120 Ų | 120 | 58.4 Ų | 58.4 | 45% | 0.453 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -56.6 | -36.2 | 176.4 | 174.9 | 172.9 | 52.8 | 75.4 | -7.7 | 113 | E538 Q542 G548 | E538-R546 VanDerWaalsContact CD-NE 3.32Å; E538-R546 VanDerWaalsContact OE1-CD 3.3Å; E538-R546 WeakPolarHBondContact OE1-CD 3.3Å; E538-R546 IonicContact OE1-CZ 2.74Å; E538-R546 IonicContact OE1-NE 2.65Å; E538-R546 PolarHBondContact OE1-NE 3.17Å; E538-R546 IonicContact OE1-NH2 3.96Å; E538-R546 IonicContact OE2-CZ 2.68Å; E538-R546 IonicContact OE2-NE 3.24Å; E538-R546 PolarHBondContact OE2-NE 3.39Å; E538-R546 VanDerWaalsContact OE2-NE 3.12Å; E538-R546 IonicContact OE2-NH2 2.96Å; E538-R546 PolarHBondContact OE2-NH2 3.35Å; Q542-R546 PolarHBondContact O-N 3.39Å; R546-G548 VanDerWaalsContact C-N 3.31Å |
| 547 | Q | 95.9 | Very high | 96.5 | Very high | 90 Ų | 90 | 58 Ų | 58 | 42% | 0.421 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | 4.6 | 179 | -55 | -72.6 | 74.8 | 0 | 0 | 112.6 | Q513 S543 A544 E545 H549 | Q513-Q547 HydrophobicContact CB-CG 4.19Å; Q513-Q547 HydrophobicContact CG-CG 4.28Å; Q513-Q547 WeakPolarHBondContact O-CG 3.16Å; S543-Q547 WeakPolarHBondContact O-CG 3.28Å; S543-Q547 PolarHBondContact O-N 3.19Å; A544-Q547 PolarHBondContact O-N 3.3Å; E545-Q547 PolarHBondContact O-N 2.89Å; Q547-H549 VanDerWaalsContact C-N 3.35Å; Q547-H549 PolarHBondContact O-N 3.49Å |
| 548 | G | 95.9 | Very high | 96.6 | Very high | 50 Ų | 50 | 60.3 Ų | 60.3 | 52% | 0.515 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 81.6 | 3.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | A544 E545 R546 T550 | A544-G548 PolarHBondContact O-N 3.2Å; E545-G548 PolarHBondContact O-N 3.32Å; R546-G548 VanDerWaalsContact C-N 3.31Å; G548-T550 PolarHBondContact O-N 3.27Å |
| 549 | H | 97.5 | Very high | 96.6 | Very high | 61 Ų | 61 | 59.5 Ų | 59.5 | 28% | 0.282 | 30% | 0.298 | S | S | . | . | trans | -80.5 | 62 | -178 | -59.5 | -54.6 | 0 | 0 | 0 | 112.2 | S512 Q513 H514 G515 A544 Q547 L551 C552 S553 | S512-H549 PolarHBondContact O-CD2 3.43Å; Q513-H549 PolarHBondContact O-NE2 2.98Å; H514-H549 VanDerWaalsContact C-NE2 3.26Å; G515-H549 PolarHBondContact N-CD2 3.48Å; G515-H549 VanDerWaalsContact N-CD2 3.27Å; G515-H549 PolarHBondContact N-NE2 3.17Å; A544-H549 HydrophobicContact CB-CB 4.3Å; A544-H549 WeakPolarHBondContact O-CA 3.35Å; A544-H549 PolarHBondContact O-N 2.85Å; Q547-H549 VanDerWaalsContact C-N 3.35Å; Q547-H549 PolarHBondContact O-N 3.49Å; H549-L551 VanDerWaalsContact C-N 3.27Å; H549-L551 PolarHBondContact O-N 3.13Å; H549-L551 VanDerWaalsContact O-N 3.15Å; H549-C552 HydrophobicContact CB-CB 4.17Å; H549-C552 WeakPolarHBondContact O-CB 3.37Å; H549-C552 PolarHBondContact O-N 3.05Å; H549-S553 PolarHBondContact O-N 3.32Å | ||
| 550 | T | 96.3 | Very high | 96.4 | Very high | 90 Ų | 90 | 57.9 Ų | 57.9 | 55% | 0.552 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -53.6 | -35.5 | -174.3 | 56.2 | 0 | 0 | 0 | 0 | 114.5 | G548 R554 | G548-T550 PolarHBondContact O-N 3.27Å; T550-R554 WeakPolarHBondContact O-CB 3.46Å; T550-R554 VanDerWaalsContact O-CG 3.26Å; T550-R554 WeakPolarHBondContact O-CG 3.3Å; T550-R554 PolarHBondContact O-N 2.9Å |
| 551 | L | 97 | Very high | 96.3 | Very high | 123 Ų | 123 | 61.9 Ų | 61.9 | 64% | 0.644 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -65.4 | -41.7 | 175.4 | -67.2 | 178 | 0 | 0 | 0 | 112.2 | H549 Y555 | H549-L551 VanDerWaalsContact C-N 3.27Å; H549-L551 PolarHBondContact O-N 3.13Å; H549-L551 VanDerWaalsContact O-N 3.15Å; L551-Y555 WeakPolarHBondContact O-CB 3.36Å; L551-Y555 PolarHBondContact O-N 3.41Å |
| 552 | C | 97.4 | Very high | 96.1 | Very high | 3 Ų | 3 | 65.1 Ų | 65.1 | 2% | 0.02 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -68.2 | -45.8 | 177.4 | -64.1 | 0 | 0 | 0 | 0 | 110.8 | G515 I520 A544 H549 Y555 L556 | G515-C552 PolarHBondContact O-SG 3.44Å; I520-C552 HydrophobicContact CD1-CB 3.64Å; A544-C552 HydrophobicContact CB-CB 3.98Å; H549-C552 HydrophobicContact CB-CB 4.17Å; H549-C552 WeakPolarHBondContact O-CB 3.37Å; H549-C552 PolarHBondContact O-N 3.05Å; C552-Y555 PolarHBondContact O-N 3.37Å; C552-L556 WeakPolarHBondContact O-CB 3.34Å; C552-L556 WeakPolarHBondContact O-CD1 3.4Å; C552-L556 WeakPolarHBondContact O-CG 3.27Å; C552-L556 PolarHBondContact O-N 2.86Å |
| 553 | S | 97.3 | Very high | 95.8 | Very high | 11 Ų | 11 | 65.6 Ų | 65.6 | 8% | 0.077 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -57.1 | -50.7 | 175.1 | -179.7 | 0 | 0 | 0 | 0 | 111.7 | S541 H549 Y555 L556 V557 | S541-S553 VanDerWaalsContact O-CB 3.26Å; S541-S553 WeakPolarHBondContact O-CB 3.36Å; S541-S553 PolarHBondContact O-OG 2.94Å; H549-S553 PolarHBondContact O-N 3.32Å; S553-Y555 PolarHBondContact O-N 3.3Å; S553-L556 PolarHBondContact O-N 3.23Å; S553-V557 WeakPolarHBondContact O-CG2 3.35Å; S553-V557 PolarHBondContact O-N 3.45Å |
| 554 | R | 96.9 | Very high | 95.6 | Very high | 187 Ų | 187 | 69.7 Ų | 69.7 | 71% | 0.706 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -61.7 | -40.1 | 177.8 | -73.5 | 178.8 | 69.6 | 177.8 | 2.5 | 112.9 | T550 V558 | T550-R554 WeakPolarHBondContact O-CB 3.46Å; T550-R554 VanDerWaalsContact O-CG 3.26Å; T550-R554 WeakPolarHBondContact O-CG 3.3Å; T550-R554 PolarHBondContact O-N 2.9Å; R554-V558 WeakPolarHBondContact O-CG2 3.28Å; R554-V558 PolarHBondContact O-N 2.73Å |
| 555 | Y | 97.8 | Very high | 95.4 | Very high | 61 Ų | 61 | 75.1 Ų | 75.1 | 24% | 0.239 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.5 | -48.9 | 174.2 | 174.4 | -101.2 | 0 | 0 | 0 | 111.1 | L517 I520 Q521 V524 L551 C552 S553 V557 V558 V559 | L517-Y555 HydrophobicContact CD1-CD1 3.84Å; L517-Y555 HydrophobicContact CD1-CD2 4.42Å; L517-Y555 HydrophobicContact CD1-CG 3.74Å; I520-Y555 HydrophobicContact CG2-CD1 3.97Å; I520-Y555 HydrophobicContact CG2-CE1 4Å; Q521-Y555 HydrophobicContact CG-CD1 4.49Å; Q521-Y555 HydrophobicContact CG-CE1 3.84Å; Q521-Y555 HydrophobicContact CG-CE2 3.95Å; V524-Y555 HydrophobicContact CG2-CE1 4.21Å; L551-Y555 WeakPolarHBondContact O-CB 3.36Å; L551-Y555 PolarHBondContact O-N 3.41Å; C552-Y555 PolarHBondContact O-N 3.37Å; S553-Y555 PolarHBondContact O-N 3.3Å; Y555-V557 PolarHBondContact O-N 2.89Å; Y555-V558 WeakPolarHBondContact O-CB 3.48Å; Y555-V558 PolarHBondContact O-N 3.25Å; Y555-V558 VanDerWaalsContact O-N 3.17Å; Y555-V559 HydrophobicContact CD1-CG2 4.19Å; Y555-V559 HydrophobicContact CD2-CG2 4.44Å; Y555-V559 HydrophobicContact CE1-CG2 3.69Å; Y555-V559 HydrophobicContact CE2-CG2 3.97Å; Y555-V559 WeakPolarHBondContact O-CG2 3.49Å; Y555-V559 PolarHBondContact O-N 3.04Å |
| 556 | L | 96.4 | Very high | 95.2 | Very high | 0 Ų | 0 | 71.3 Ų | 71.3 | 0% | 0 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -62.9 | -42.5 | -179.6 | -74.2 | 158.1 | 0 | 0 | 0 | 112.6 | V508 S512 I520 V530 P540 C552 S553 V558 V559 E560 | V508-L556 HydrophobicContact CG1-CD2 3.97Å; S512-L556 VanDerWaalsContact OG-CD1 3.22Å; S512-L556 WeakPolarHBondContact OG-CD1 3.4Å; I520-L556 HydrophobicContact CD1-CD1 4.44Å; I520-L556 HydrophobicContact CG2-CD1 4.17Å; I520-L556 HydrophobicContact CG2-CD2 3.64Å; I520-L556 HydrophobicContact CG2-CG 3.91Å; V530-L556 HydrophobicContact CB-CD2 4.16Å; V530-L556 HydrophobicContact CG1-CD2 3.69Å; P540-L556 HydrophobicContact CB-CD1 4.02Å; P540-L556 HydrophobicContact CB-CD2 4.36Å; C552-L556 WeakPolarHBondContact O-CB 3.34Å; C552-L556 WeakPolarHBondContact O-CD1 3.4Å; C552-L556 WeakPolarHBondContact O-CG 3.27Å; C552-L556 PolarHBondContact O-N 2.86Å; S553-L556 PolarHBondContact O-N 3.23Å; L556-V558 VanDerWaalsContact C-N 3.29Å; L556-V558 PolarHBondContact O-N 2.89Å; L556-V559 PolarHBondContact O-N 3.31Å; L556-V559 VanDerWaalsContact O-N 3.13Å; L556-E560 WeakPolarHBondContact O-CB 3.46Å; L556-E560 WeakPolarHBondContact O-CG 3.35Å; L556-E560 PolarHBondContact O-N 2.85Å |
| 557 | V | 96.3 | Very high | 94.9 | Very high | 68 Ų | 68 | 69.4 Ų | 69.4 | 41% | 0.412 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -61.3 | -37.1 | 174.9 | 172.5 | 0 | 0 | 0 | 0 | 111.8 | S553 Y555 T561 | S553-V557 WeakPolarHBondContact O-CG2 3.35Å; S553-V557 PolarHBondContact O-N 3.45Å; Y555-V557 PolarHBondContact O-N 2.89Å; V557-T561 WeakPolarHBondContact O-CB 3.46Å; V557-T561 WeakPolarHBondContact O-CG2 3.45Å; V557-T561 PolarHBondContact O-N 3.29Å; V557-T561 PolarHBondContact O-OG1 3.17Å |
| 558 | V | 96.3 | Very high | 94.9 | Very high | 85 Ų | 85 | 69.4 Ų | 69.4 | 52% | 0.515 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -67.4 | -42.3 | 173 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | R554 Y555 L556 T561 C562 | R554-V558 WeakPolarHBondContact O-CG2 3.28Å; R554-V558 PolarHBondContact O-N 2.73Å; Y555-V558 WeakPolarHBondContact O-CB 3.48Å; Y555-V558 PolarHBondContact O-N 3.25Å; Y555-V558 VanDerWaalsContact O-N 3.17Å; L556-V558 VanDerWaalsContact C-N 3.29Å; L556-V558 PolarHBondContact O-N 2.89Å; V558-T561 PolarHBondContact O-OG1 3.02Å; V558-T561 VanDerWaalsContact O-OG1 3.13Å; V558-C562 VanDerWaalsContact O-CB 3.25Å; V558-C562 WeakPolarHBondContact O-CB 3.39Å; V558-C562 PolarHBondContact O-N 2.93Å; V558-C562 PolarHBondContact O-SG 2.77Å |
| 559 | V | 95.3 | Very high | 94.8 | Very high | 19 Ų | 19 | 70.7 Ų | 70.7 | 12% | 0.115 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -63.1 | -47.7 | 175.7 | 175.5 | 0 | 0 | 0 | 0 | 111.3 | V524 V530 Y555 L556 T561 C562 M563 | V524-V559 HydrophobicContact CG1-CG1 3.65Å; V524-V559 HydrophobicContact CG1-CG2 4.06Å; V524-V559 HydrophobicContact CG2-CG1 4.09Å; V530-V559 HydrophobicContact CG1-CG1 4.2Å; V530-V559 HydrophobicContact CG2-CG1 4.02Å; Y555-V559 HydrophobicContact CD1-CG2 4.19Å; Y555-V559 HydrophobicContact CD2-CG2 4.44Å; Y555-V559 HydrophobicContact CE1-CG2 3.69Å; Y555-V559 HydrophobicContact CE2-CG2 3.97Å; Y555-V559 WeakPolarHBondContact O-CG2 3.49Å; Y555-V559 PolarHBondContact O-N 3.04Å; L556-V559 PolarHBondContact O-N 3.31Å; L556-V559 VanDerWaalsContact O-N 3.13Å; V559-T561 PolarHBondContact O-N 3Å; V559-C562 PolarHBondContact O-N 2.71Å; V559-M563 HydrophobicContact CG1-CG 4.15Å; V559-M563 WeakPolarHBondContact O-CB 3.46Å; V559-M563 WeakPolarHBondContact O-CG 3.37Å; V559-M563 PolarHBondContact O-N 3.24Å |
| 560 | E | 93.2 | Very high | 94.7 | Very high | 26 Ų | 26 | 71.8 Ų | 71.8 | 12% | 0.121 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -56.5 | -47.7 | 177.3 | -75.9 | -174.1 | -117.6 | 0 | 0 | 112.2 | V530 T531 K539 S541 L556 M563 S564 | V530-E560 HydrophobicContact CB-CG 4.33Å; V530-E560 HydrophobicContact CG2-CG 3.8Å; T531-E560 HydrophobicContact CG2-CG 4.38Å; K539-E560 VanDerWaalsContact CD-OE2 3.3Å; K539-E560 WeakPolarHBondContact CD-OE2 3.22Å; K539-E560 WeakPolarHBondContact CE-OE2 3.48Å; K539-E560 IonicContact NZ-OE2 2.73Å; K539-E560 PolarHBondContact NZ-OE2 3.22Å; S541-E560 VanDerWaalsContact CB-OE1 3.25Å; S541-E560 WeakPolarHBondContact CB-OE1 3.49Å; S541-E560 PolarHBondContact OG-OE1 3.35Å; L556-E560 WeakPolarHBondContact O-CB 3.46Å; L556-E560 WeakPolarHBondContact O-CG 3.35Å; L556-E560 PolarHBondContact O-N 2.85Å; E560-M563 PolarHBondContact O-N 3.04Å; E560-S564 WeakPolarHBondContact O-CB 3.4Å; E560-S564 PolarHBondContact O-N 3.22Å |
| 561 | T | 93.6 | Very high | 94.6 | Very high | 83 Ų | 83 | 73.5 Ų | 73.5 | 51% | 0.509 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -69.3 | -39.1 | -179.8 | 49.5 | 0 | 0 | 0 | 0 | 112.2 | V557 V558 V559 S564 L565 | V557-T561 WeakPolarHBondContact O-CB 3.46Å; V557-T561 WeakPolarHBondContact O-CG2 3.45Å; V557-T561 PolarHBondContact O-N 3.29Å; V557-T561 PolarHBondContact O-OG1 3.17Å; V558-T561 PolarHBondContact O-OG1 3.02Å; V558-T561 VanDerWaalsContact O-OG1 3.13Å; V559-T561 PolarHBondContact O-N 3Å; T561-S564 PolarHBondContact O-N 2.87Å; T561-L565 WeakPolarHBondContact O-CB 3.25Å; T561-L565 PolarHBondContact O-N 3.15Å |
| 562 | C | 93.3 | Very high | 94.6 | Very high | 74 Ų | 74 | 72 Ų | 72 | 50% | 0.5 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 172.3 | -76.2 | 0 | 0 | 0 | 0 | 112.6 | V558 V559 L565 A566 | V558-C562 VanDerWaalsContact O-CB 3.25Å; V558-C562 WeakPolarHBondContact O-CB 3.39Å; V558-C562 PolarHBondContact O-N 2.93Å; V558-C562 PolarHBondContact O-SG 2.77Å; V559-C562 PolarHBondContact O-N 2.71Å; C562-L565 PolarHBondContact O-N 3.09Å; C562-A566 VanDerWaalsContact O-CB 3.27Å; C562-A566 WeakPolarHBondContact O-CB 3.44Å; C562-A566 PolarHBondContact O-N 3.32Å |
| 563 | M | 89.9 | Confident | 94.5 | Very high | 97 Ų | 97 | 74.6 Ų | 74.6 | 48% | 0.478 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -66.2 | -41.2 | 177.9 | -71.9 | -70.3 | -84.3 | 0 | 0 | 111.8 | V559 E560 A566 S567 | V559-M563 HydrophobicContact CG1-CG 4.15Å; V559-M563 WeakPolarHBondContact O-CB 3.46Å; V559-M563 WeakPolarHBondContact O-CG 3.37Å; V559-M563 PolarHBondContact O-N 3.24Å; E560-M563 PolarHBondContact O-N 3.04Å; M563-A566 PolarHBondContact O-N 3.03Å; M563-S567 WeakPolarHBondContact O-CB 3.46Å; M563-S567 PolarHBondContact O-N 3.35Å |
| 564 | S | 90.9 | Very high | 94.4 | Very high | 85 Ų | 85 | 79.3 Ų | 79.3 | 59% | 0.594 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -61.4 | -47.6 | 174 | -173.1 | 0 | 0 | 0 | 0 | 111.9 | E560 T561 S567 Q568 | E560-S564 WeakPolarHBondContact O-CB 3.4Å; E560-S564 PolarHBondContact O-N 3.22Å; T561-S564 PolarHBondContact O-N 2.87Å; S564-S567 PolarHBondContact O-N 3.13Å; S564-Q568 PolarHBondContact O-N 3.35Å |
| 565 | L | 93.8 | Very high | 94.3 | Very high | 114 Ų | 114 | 75 Ų | 75 | 60% | 0.597 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -63.4 | -43 | 177 | -179.2 | 60.2 | 0 | 0 | 0 | 111.9 | T561 C562 S567 Q568 V569 | T561-L565 WeakPolarHBondContact O-CB 3.25Å; T561-L565 PolarHBondContact O-N 3.15Å; C562-L565 PolarHBondContact O-N 3.09Å; L565-S567 PolarHBondContact O-N 2.95Å; L565-Q568 PolarHBondContact O-N 3.1Å; L565-V569 HydrophobicContact CD1-CG2 4.32Å; L565-V569 WeakPolarHBondContact O-CG2 3.2Å; L565-V569 PolarHBondContact O-N 2.84Å |
| 566 | A | 91.4 | Very high | 94.2 | Very high | 50 Ų | 50 | 77.7 Ų | 77.7 | 41% | 0.413 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -60.8 | -44.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | C562 M563 Q568 V569 V570 | C562-A566 VanDerWaalsContact O-CB 3.27Å; C562-A566 WeakPolarHBondContact O-CB 3.44Å; C562-A566 PolarHBondContact O-N 3.32Å; M563-A566 PolarHBondContact O-N 3.03Å; A566-Q568 PolarHBondContact O-N 2.93Å; A566-V569 PolarHBondContact O-N 2.92Å; A566-V570 WeakPolarHBondContact O-CG2 3.03Å; A566-V570 PolarHBondContact O-N 3.15Å |
| 567 | S | 91.1 | Very high | 94.2 | Very high | 81 Ų | 81 | 84.3 Ų | 84.3 | 57% | 0.566 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -58.8 | -45.7 | 174.7 | -176.1 | 0 | 0 | 0 | 0 | 111.9 | M563 S564 L565 V569 V570 K571 | M563-S567 WeakPolarHBondContact O-CB 3.46Å; M563-S567 PolarHBondContact O-N 3.35Å; S564-S567 PolarHBondContact O-N 3.13Å; L565-S567 PolarHBondContact O-N 2.95Å; S567-V569 PolarHBondContact O-N 3.1Å; S567-V570 PolarHBondContact O-N 3.3Å; S567-K571 WeakPolarHBondContact O-CB 3.5Å; S567-K571 PolarHBondContact O-N 3.44Å |
| 568 | Q | 94.3 | Very high | 94.2 | Very high | 90 Ų | 90 | 85 Ų | 85 | 42% | 0.421 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -66 | -38.3 | 176.9 | -177.3 | 59.7 | 15.1 | 0 | 0 | 112.5 | S564 L565 A566 K571 L572 | S564-Q568 PolarHBondContact O-N 3.35Å; L565-Q568 PolarHBondContact O-N 3.1Å; A566-Q568 PolarHBondContact O-N 2.93Å; Q568-K571 PolarHBondContact O-N 3.38Å; Q568-L572 HydrophobicContact CG-CD1 4.13Å; Q568-L572 WeakPolarHBondContact O-CB 3.42Å; Q568-L572 WeakPolarHBondContact O-CG 3.43Å; Q568-L572 PolarHBondContact O-N 2.95Å |
| 569 | V | 95.8 | Very high | 94.1 | Very high | 76 Ų | 76 | 86.4 Ų | 86.4 | 46% | 0.461 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 174.4 | 168.3 | 0 | 0 | 0 | 0 | 111.2 | L565 A566 S567 T573 | L565-V569 HydrophobicContact CD1-CG2 4.32Å; L565-V569 WeakPolarHBondContact O-CG2 3.2Å; L565-V569 PolarHBondContact O-N 2.84Å; A566-V569 PolarHBondContact O-N 2.92Å; S567-V569 PolarHBondContact O-N 3.1Å; V569-T573 VanDerWaalsContact O-CB 3.23Å; V569-T573 WeakPolarHBondContact O-CB 3.24Å; V569-T573 PolarHBondContact O-N 3.17Å; V569-T573 PolarHBondContact O-OG1 3.27Å |
| 570 | V | 94.9 | Very high | 94.1 | Very high | 85 Ų | 85 | 89.1 Ų | 89.1 | 52% | 0.515 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.4 | -44.5 | 174.3 | 169.8 | 0 | 0 | 0 | 0 | 110.9 | A566 S567 T573 K574 | A566-V570 WeakPolarHBondContact O-CG2 3.03Å; A566-V570 PolarHBondContact O-N 3.15Å; S567-V570 PolarHBondContact O-N 3.3Å; V570-T573 PolarHBondContact O-N 2.93Å; V570-K574 PolarHBondContact O-N 2.93Å |
| 571 | K | 94.8 | Very high | 94.3 | Very high | 126 Ų | 126 | 92.3 Ų | 92.3 | 55% | 0.548 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.8 | -49.1 | 177.6 | -172.4 | 173.8 | -177.4 | 174.9 | 0 | 112.3 | S567 Q568 T573 K574 Q575 | S567-K571 WeakPolarHBondContact O-CB 3.5Å; S567-K571 PolarHBondContact O-N 3.44Å; Q568-K571 PolarHBondContact O-N 3.38Å; K571-T573 VanDerWaalsContact C-N 3.32Å; K571-T573 PolarHBondContact O-N 3.38Å; K571-K574 PolarHBondContact O-N 3.36Å; K571-Q575 WeakPolarHBondContact O-CG 3.24Å; K571-Q575 PolarHBondContact O-N 2.97Å |
| 572 | L | 95.4 | Very high | 94.3 | Very high | 90 Ų | 90 | 92.9 Ų | 92.9 | 47% | 0.471 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.2 | -37.4 | 175.4 | -70.2 | 170.4 | 0 | 0 | 0 | 112 | Q568 Q575 L576 | Q568-L572 HydrophobicContact CG-CD1 4.13Å; Q568-L572 WeakPolarHBondContact O-CB 3.42Å; Q568-L572 WeakPolarHBondContact O-CG 3.43Å; Q568-L572 PolarHBondContact O-N 2.95Å; L572-Q575 PolarHBondContact O-N 3.34Å; L572-L576 VanDerWaalsContact O-CB 3.32Å; L572-L576 WeakPolarHBondContact O-CB 3.25Å; L572-L576 PolarHBondContact O-N 3.21Å |
| 573 | T | 95.1 | Very high | 94.4 | Very high | 58 Ų | 58 | 98.5 Ų | 98.5 | 36% | 0.356 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.8 | -35.6 | 176.7 | -59.6 | 0 | 0 | 0 | 0 | 112.1 | V569 V570 K571 K577 | V569-T573 VanDerWaalsContact O-CB 3.23Å; V569-T573 WeakPolarHBondContact O-CB 3.24Å; V569-T573 PolarHBondContact O-N 3.17Å; V569-T573 PolarHBondContact O-OG1 3.27Å; V570-T573 PolarHBondContact O-N 2.93Å; K571-T573 VanDerWaalsContact C-N 3.32Å; K571-T573 PolarHBondContact O-N 3.38Å; T573-K577 HydrophobicContact CG2-CD 4.39Å; T573-K577 VanDerWaalsContact O-CG 3.28Å; T573-K577 WeakPolarHBondContact O-CG 3.38Å; T573-K577 PolarHBondContact O-N 2.87Å; T573-K577 VanDerWaalsContact O-N 3.07Å |
| 574 | K | 95.7 | Very high | 94.7 | Very high | 111 Ų | 111 | 97.2 Ų | 97.2 | 48% | 0.483 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.2 | -52.4 | 172 | 176.8 | 173.3 | 170.6 | 175.7 | 0 | 110.5 | V570 K571 L576 K577 E578 | V570-K574 PolarHBondContact O-N 2.93Å; K571-K574 PolarHBondContact O-N 3.36Å; K574-L576 VanDerWaalsContact C-N 3.32Å; K574-L576 PolarHBondContact O-N 2.85Å; K574-K577 WeakPolarHBondContact O-CB 3.33Å; K574-K577 PolarHBondContact O-N 2.86Å; K574-E578 WeakPolarHBondContact CE-OE1 3.45Å; K574-E578 HydrophobicContact CG-CG 4.48Å; K574-E578 IonicContact NZ-OE1 2.94Å; K574-E578 WeakPolarHBondContact O-CG 3.44Å; K574-E578 PolarHBondContact O-N 3.09Å |
| 575 | Q | 95.9 | Very high | 94.9 | Very high | 95 Ų | 95 | 96.1 Ų | 96.1 | 44% | 0.444 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.4 | -41.3 | 178 | -69.3 | 177.3 | -45 | 0 | 0 | 112.6 | K571 L572 K577 E578 Q579 | K571-Q575 WeakPolarHBondContact O-CG 3.24Å; K571-Q575 PolarHBondContact O-N 2.97Å; L572-Q575 PolarHBondContact O-N 3.34Å; Q575-K577 PolarHBondContact O-N 3.4Å; Q575-E578 WeakPolarHBondContact CA-OE2 3.34Å; Q575-E578 PolarHBondContact O-N 3.06Å; Q575-Q579 WeakPolarHBondContact O-CB 3.2Å; Q575-Q579 WeakPolarHBondContact O-CG 3.47Å; Q575-Q579 PolarHBondContact O-N 2.99Å |
| 576 | L | 95.7 | Very high | 94.9 | Very high | 118 Ų | 118 | 95.9 Ų | 95.9 | 62% | 0.618 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.2 | -37.2 | 176.4 | -178.4 | 61.7 | 0 | 0 | 0 | 112.4 | L572 K574 T580 | L572-L576 VanDerWaalsContact O-CB 3.32Å; L572-L576 WeakPolarHBondContact O-CB 3.25Å; L572-L576 PolarHBondContact O-N 3.21Å; K574-L576 VanDerWaalsContact C-N 3.32Å; K574-L576 PolarHBondContact O-N 2.85Å; L576-T580 VanDerWaalsContact O-CB 3.31Å; L576-T580 WeakPolarHBondContact O-CB 3.3Å; L576-T580 PolarHBondContact O-N 3.43Å; L576-T580 PolarHBondContact O-OG1 3Å |
| 577 | K | 95.3 | Very high | 95 | Very high | 139 Ų | 139 | 99.4 Ų | 99.4 | 60% | 0.604 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.9 | -44.7 | 174 | -75.9 | 171.4 | 178.7 | 179.3 | 0 | 111.4 | T573 K574 Q575 T580 V581 | T573-K577 HydrophobicContact CG2-CD 4.39Å; T573-K577 VanDerWaalsContact O-CG 3.28Å; T573-K577 WeakPolarHBondContact O-CG 3.38Å; T573-K577 PolarHBondContact O-N 2.87Å; T573-K577 VanDerWaalsContact O-N 3.07Å; K574-K577 WeakPolarHBondContact O-CB 3.33Å; K574-K577 PolarHBondContact O-N 2.86Å; Q575-K577 PolarHBondContact O-N 3.4Å; K577-T580 WeakPolarHBondContact O-CB 3.42Å; K577-T580 PolarHBondContact O-N 3.47Å; K577-T580 VanDerWaalsContact O-N 3.16Å; K577-V581 WeakPolarHBondContact O-CG2 3.46Å; K577-V581 PolarHBondContact O-N 3.43Å |
| 578 | E | 96 | Very high | 95.2 | Very high | 84 Ų | 84 | 100 Ų | 100 | 39% | 0.393 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.8 | -51.9 | 177.5 | -70.8 | 164 | 156.1 | 0 | 0 | 110.8 | K574 Q575 T580 V581 E582 | K574-E578 WeakPolarHBondContact CE-OE1 3.45Å; K574-E578 HydrophobicContact CG-CG 4.48Å; K574-E578 IonicContact NZ-OE1 2.94Å; K574-E578 WeakPolarHBondContact O-CG 3.44Å; K574-E578 PolarHBondContact O-N 3.09Å; Q575-E578 WeakPolarHBondContact CA-OE2 3.34Å; Q575-E578 PolarHBondContact O-N 3.06Å; E578-T580 VanDerWaalsContact C-N 3.27Å; E578-T580 PolarHBondContact O-N 3.05Å; E578-V581 PolarHBondContact O-N 2.95Å; E578-V581 VanDerWaalsContact O-N 3.07Å; E578-E582 PolarHBondContact O-N 3.46Å |
| 579 | Q | 94.4 | Very high | 95.2 | Very high | 114 Ų | 114 | 100.5 Ų | 100.5 | 53% | 0.533 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.2 | -31.5 | 174.4 | -71.9 | -66.5 | -71.2 | 0 | 0 | 113.7 | Q575 E582 R583 | Q575-Q579 WeakPolarHBondContact O-CB 3.2Å; Q575-Q579 WeakPolarHBondContact O-CG 3.47Å; Q575-Q579 PolarHBondContact O-N 2.99Å; Q579-E582 PolarHBondContact NE2-OE1 3.16Å; Q579-E582 PolarHBondContact NE2-OE2 3.5Å; Q579-R583 WeakPolarHBondContact O-CB 3.12Å; Q579-R583 PolarHBondContact O-N 3.27Å |
| 580 | T | 95.3 | Very high | 95 | Very high | 76 Ų | 76 | 102.1 Ų | 102.1 | 47% | 0.466 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -70.5 | -40.1 | 173.8 | -60.1 | 0 | 0 | 0 | 0 | 111.4 | L576 K577 E578 R583 V584 | L576-T580 VanDerWaalsContact O-CB 3.31Å; L576-T580 WeakPolarHBondContact O-CB 3.3Å; L576-T580 PolarHBondContact O-N 3.43Å; L576-T580 PolarHBondContact O-OG1 3Å; K577-T580 WeakPolarHBondContact O-CB 3.42Å; K577-T580 PolarHBondContact O-N 3.47Å; K577-T580 VanDerWaalsContact O-N 3.16Å; E578-T580 VanDerWaalsContact C-N 3.27Å; E578-T580 PolarHBondContact O-N 3.05Å; T580-R583 PolarHBondContact O-N 2.98Å; T580-V584 WeakPolarHBondContact O-CG2 3.34Å; T580-V584 PolarHBondContact O-N 3.29Å |
| 581 | V | 97 | Very high | 94.8 | Very high | 93 Ų | 93 | 102.9 Ų | 102.9 | 56% | 0.564 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65.2 | -47.2 | 175.2 | 171 | 0 | 0 | 0 | 0 | 110.5 | K577 E578 R583 V584 T585 | K577-V581 WeakPolarHBondContact O-CG2 3.46Å; K577-V581 PolarHBondContact O-N 3.43Å; E578-V581 PolarHBondContact O-N 2.95Å; E578-V581 VanDerWaalsContact O-N 3.07Å; V581-R583 VanDerWaalsContact C-N 3.33Å; V581-R583 PolarHBondContact O-N 2.94Å; V581-V584 PolarHBondContact O-N 2.95Å; V581-V584 VanDerWaalsContact O-N 3.11Å; V581-T585 HydrophobicContact CG1-CG2 4.31Å; V581-T585 WeakPolarHBondContact O-CG2 3.45Å; V581-T585 PolarHBondContact O-N 3.31Å; V581-T585 PolarHBondContact O-OG1 2.89Å |
| 582 | E | 94.8 | Very high | 94.6 | Very high | 95 Ų | 95 | 103.6 Ų | 103.6 | 44% | 0.444 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -55.9 | -44.9 | 174.5 | -72.9 | 171.2 | -136 | 0 | 0 | 112.1 | E578 Q579 V584 T585 L586 | E578-E582 PolarHBondContact O-N 3.46Å; Q579-E582 PolarHBondContact NE2-OE1 3.16Å; Q579-E582 PolarHBondContact NE2-OE2 3.5Å; E582-V584 VanDerWaalsContact C-N 3.32Å; E582-V584 PolarHBondContact O-N 3.26Å; E582-T585 WeakPolarHBondContact CA-OG1 3.3Å; E582-T585 PolarHBondContact O-N 2.98Å; E582-T585 PolarHBondContact O-OG1 3.3Å; E582-L586 WeakPolarHBondContact O-CB 3.5Å; E582-L586 VanDerWaalsContact O-CG 3.28Å; E582-L586 WeakPolarHBondContact O-CG 3.17Å; E582-L586 PolarHBondContact O-N 3.4Å |
| 583 | R | 94.6 | Very high | 94.3 | Very high | 192 Ų | 192 | 106.3 Ų | 106.3 | 73% | 0.725 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.8 | -39.5 | 176.3 | -177.4 | 176 | 176.7 | 168.9 | 1.5 | 112.3 | Q579 T580 V581 Q587 | Q579-R583 WeakPolarHBondContact O-CB 3.12Å; Q579-R583 PolarHBondContact O-N 3.27Å; T580-R583 PolarHBondContact O-N 2.98Å; V581-R583 VanDerWaalsContact C-N 3.33Å; V581-R583 PolarHBondContact O-N 2.94Å; R583-Q587 WeakPolarHBondContact O-CB 3.26Å; R583-Q587 PolarHBondContact O-N 2.64Å |
| 584 | V | 96 | Very high | 93.9 | Very high | 70 Ų | 70 | 108.3 Ų | 108.3 | 42% | 0.424 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -73.3 | -38.5 | 178.9 | 169.7 | 0 | 0 | 0 | 0 | 111.8 | T580 V581 E582 Q587 N588 | T580-V584 WeakPolarHBondContact O-CG2 3.34Å; T580-V584 PolarHBondContact O-N 3.29Å; V581-V584 PolarHBondContact O-N 2.95Å; V581-V584 VanDerWaalsContact O-N 3.11Å; E582-V584 VanDerWaalsContact C-N 3.32Å; E582-V584 PolarHBondContact O-N 3.26Å; V584-Q587 PolarHBondContact O-N 3.23Å; V584-N588 WeakPolarHBondContact O-CB 3.5Å; V584-N588 VanDerWaalsContact O-CG 3.28Å; V584-N588 PolarHBondContact O-N 2.97Å; V584-N588 PolarHBondContact O-ND2 3.44Å |
| 585 | T | 95.6 | Very high | 93.3 | Very high | 62 Ų | 62 | 107.1 Ų | 107.1 | 38% | 0.38 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.5 | -42 | 175.8 | 55.5 | 0 | 0 | 0 | 0 | 111.4 | V581 E582 Q587 N588 Q589 | V581-T585 HydrophobicContact CG1-CG2 4.31Å; V581-T585 WeakPolarHBondContact O-CG2 3.45Å; V581-T585 PolarHBondContact O-N 3.31Å; V581-T585 PolarHBondContact O-OG1 2.89Å; E582-T585 WeakPolarHBondContact CA-OG1 3.3Å; E582-T585 PolarHBondContact O-N 2.98Å; E582-T585 PolarHBondContact O-OG1 3.3Å; T585-Q587 PolarHBondContact O-N 3.48Å; T585-N588 PolarHBondContact O-N 2.96Å; T585-Q589 WeakPolarHBondContact O-CG 3.49Å; T585-Q589 PolarHBondContact O-N 3.42Å |
| 586 | L | 94.6 | Very high | 92.3 | Very high | 109 Ų | 109 | 105 Ų | 105 | 57% | 0.571 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60.8 | -41.3 | 172.2 | -72.3 | 169.8 | 0 | 0 | 0 | 112.2 | E582 Q589 L590 | E582-L586 WeakPolarHBondContact O-CB 3.5Å; E582-L586 VanDerWaalsContact O-CG 3.28Å; E582-L586 WeakPolarHBondContact O-CG 3.17Å; E582-L586 PolarHBondContact O-N 3.4Å; L586-Q589 PolarHBondContact O-N 3.2Å; L586-L590 WeakPolarHBondContact O-CB 3.48Å; L586-L590 PolarHBondContact O-N 3.5Å |
| 587 | Q | 93.6 | Very high | 91.1 | Very high | 124 Ų | 124 | 105.6 Ų | 105.6 | 58% | 0.579 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.5 | -39.5 | 175.4 | -175.8 | 173.2 | -8.8 | 0 | 0 | 112.2 | R583 V584 T585 L590 Q591 | R583-Q587 WeakPolarHBondContact O-CB 3.26Å; R583-Q587 PolarHBondContact O-N 2.64Å; V584-Q587 PolarHBondContact O-N 3.23Å; T585-Q587 PolarHBondContact O-N 3.48Å; Q587-L590 PolarHBondContact O-N 3.45Å; Q587-Q591 PolarHBondContact O-N 2.85Å |
| 588 | N | 93.7 | Very high | 89.7 | Confident | 92 Ų | 92 | 106.1 Ų | 106.1 | 49% | 0.492 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -68.7 | -39.4 | 176 | -73 | -23.7 | 0 | 0 | 0 | 112.3 | V584 T585 Q591 Q592 | V584-N588 WeakPolarHBondContact O-CB 3.5Å; V584-N588 VanDerWaalsContact O-CG 3.28Å; V584-N588 PolarHBondContact O-N 2.97Å; V584-N588 PolarHBondContact O-ND2 3.44Å; T585-N588 PolarHBondContact O-N 2.96Å; N588-Q591 PolarHBondContact O-N 3.46Å; N588-Q592 WeakPolarHBondContact O-CG 3.36Å; N588-Q592 PolarHBondContact O-N 2.87Å |
| 589 | Q | 94.8 | Very high | 87.9 | Confident | 102 Ų | 102 | 105.8 Ų | 105.8 | 48% | 0.477 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 172.6 | -73.4 | 173.5 | 7.3 | 0 | 0 | 111.1 | T585 L586 Q591 Q592 F593 | T585-Q589 WeakPolarHBondContact O-CG 3.49Å; T585-Q589 PolarHBondContact O-N 3.42Å; L586-Q589 PolarHBondContact O-N 3.2Å; Q589-Q591 VanDerWaalsContact C-N 3.35Å; Q589-Q591 PolarHBondContact O-N 2.73Å; Q589-Q592 PolarHBondContact O-N 2.95Å; Q589-F593 WeakPolarHBondContact O-CD2 3.47Å; Q589-F593 PolarHBondContact O-N 3Å |
| 590 | L | 92.6 | Very high | 85.9 | Confident | 109 Ų | 109 | 107.1 Ų | 107.1 | 57% | 0.571 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60 | -44 | 175.5 | -171 | 73.5 | 0 | 0 | 0 | 111.5 | L586 Q587 Q592 F593 L594 | L586-L590 WeakPolarHBondContact O-CB 3.48Å; L586-L590 PolarHBondContact O-N 3.5Å; Q587-L590 PolarHBondContact O-N 3.45Å; L590-Q592 PolarHBondContact O-N 2.55Å; L590-F593 PolarHBondContact O-N 1.87Å; L590-L594 HydrophobicContact CG-CD1 4.24Å; L590-L594 VanDerWaalsContact O-CG 3.3Å; L590-L594 WeakPolarHBondContact O-CG 3.4Å; L590-L594 PolarHBondContact O-N 2.62Å |
| 591 | Q | 91.1 | Very high | 83.8 | Confident | 101 Ų | 101 | 107 Ų | 107 | 47% | 0.472 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61 | -43.6 | 174.9 | -175.2 | 63.6 | 40.1 | 0 | 0 | 111.6 | Q587 N588 Q589 L594 E595 | Q587-Q591 PolarHBondContact O-N 2.85Å; N588-Q591 PolarHBondContact O-N 3.46Å; Q589-Q591 VanDerWaalsContact C-N 3.35Å; Q589-Q591 PolarHBondContact O-N 2.73Å; Q591-L594 PolarHBondContact O-N 3.2Å; Q591-E595 PolarHBondContact NE2-OE2 3.15Å; Q591-E595 WeakPolarHBondContact O-CB 3.04Å; Q591-E595 PolarHBondContact O-N 3.1Å |
| 592 | Q | 89.1 | Confident | 81.4 | Confident | 141 Ų | 141 | 111.6 Ų | 111.6 | 66% | 0.659 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -62.9 | -42 | 177 | -74.9 | 178.7 | -9.5 | 0 | 0 | 112.3 | N588 Q589 L590 L594 E595 A596 | N588-Q592 WeakPolarHBondContact O-CG 3.36Å; N588-Q592 PolarHBondContact O-N 2.87Å; Q589-Q592 PolarHBondContact O-N 2.95Å; L590-Q592 PolarHBondContact O-N 2.55Å; Q592-L594 VanDerWaalsContact C-N 3.35Å; Q592-L594 PolarHBondContact O-N 2.91Å; Q592-E595 PolarHBondContact O-N 2.99Å; Q592-A596 VanDerWaalsContact O-CB 3.28Å; Q592-A596 WeakPolarHBondContact O-CB 3.25Å; Q592-A596 PolarHBondContact O-N 3.34Å |
| 593 | F | 88.6 | Confident | 78.8 | Confident | 147 Ų | 147 | 111.8 Ų | 111.8 | 65% | 0.645 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -61.6 | -40.7 | 173.7 | -91.7 | -74 | 0 | 0 | 0 | 112.4 | Q589 L590 A596 Q597 | Q589-F593 WeakPolarHBondContact O-CD2 3.47Å; Q589-F593 PolarHBondContact O-N 3Å; L590-F593 PolarHBondContact O-N 1.87Å; F593-A596 PolarHBondContact O-N 3.16Å; F593-Q597 WeakPolarHBondContact O-CB 3.33Å; F593-Q597 WeakPolarHBondContact O-CG 3.47Å; F593-Q597 PolarHBondContact O-N 3.4Å |
| 594 | L | 87.2 | Confident | 76.2 | Confident | 100 Ų | 100 | 110.9 Ų | 110.9 | 52% | 0.524 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -68.1 | -37.2 | 176.9 | -69.9 | 168.8 | 0 | 0 | 0 | 112.4 | L590 Q591 Q592 K598 | L590-L594 HydrophobicContact CG-CD1 4.24Å; L590-L594 VanDerWaalsContact O-CG 3.3Å; L590-L594 WeakPolarHBondContact O-CG 3.4Å; L590-L594 PolarHBondContact O-N 2.62Å; Q591-L594 PolarHBondContact O-N 3.2Å; Q592-L594 VanDerWaalsContact C-N 3.35Å; Q592-L594 PolarHBondContact O-N 2.91Å; L594-K598 VanDerWaalsContact O-CB 3.28Å; L594-K598 WeakPolarHBondContact O-CB 3.46Å; L594-K598 PolarHBondContact O-N 2.89Å |
| 595 | E | 83.5 | Confident | 73.7 | Confident | 87 Ų | 87 | 113.1 Ų | 113.1 | 41% | 0.407 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -71.9 | -36 | 175.7 | -140.2 | 70.9 | -120.6 | 0 | 0 | 111.9 | Q591 Q592 K598 S599 | Q591-E595 PolarHBondContact NE2-OE2 3.15Å; Q591-E595 WeakPolarHBondContact O-CB 3.04Å; Q591-E595 PolarHBondContact O-N 3.1Å; Q592-E595 PolarHBondContact O-N 2.99Å; E595-K598 WeakPolarHBondContact O-CB 3.44Å; E595-K598 PolarHBondContact O-N 3.09Å; E595-K598 WeakPolarHBondContact OE1-CD 3.42Å; E595-K598 WeakPolarHBondContact OE1-CE 3.45Å; E595-K598 IonicContact OE1-NZ 2.71Å; E595-K598 PolarHBondContact OE1-NZ 2.89Å; E595-S599 PolarHBondContact O-N 3.08Å |
| 596 | A | 75.9 | Confident | 70.8 | Confident | 49 Ų | 49 | 115 Ų | 115 | 41% | 0.405 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -65.4 | -49.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q592 F593 K598 S599 E600 | Q592-A596 VanDerWaalsContact O-CB 3.28Å; Q592-A596 WeakPolarHBondContact O-CB 3.25Å; Q592-A596 PolarHBondContact O-N 3.34Å; F593-A596 PolarHBondContact O-N 3.16Å; A596-K598 PolarHBondContact O-N 3.48Å; A596-S599 WeakPolarHBondContact O-CA 3.47Å; A596-S599 WeakPolarHBondContact O-CB 3.43Å; A596-S599 PolarHBondContact O-N 3.23Å; A596-S599 PolarHBondContact O-OG 2.94Å; A596-E600 PolarHBondContact O-N 3.49Å |
| 597 | Q | 70.1 | Confident | 68 | Low | 132 Ų | 132 | 115.3 Ų | 115.3 | 62% | 0.617 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -56.1 | -35.2 | 174.5 | -77.8 | -72.4 | -30.5 | 0 | 0 | 112.4 | F593 S599 | F593-Q597 WeakPolarHBondContact O-CB 3.33Å; F593-Q597 WeakPolarHBondContact O-CG 3.47Å; F593-Q597 PolarHBondContact O-N 3.4Å; Q597-S599 PolarHBondContact O-N 2.8Å |
| 598 | K | 66.3 | Low | 66.2 | Low | 149 Ų | 149 | 115 Ų | 115 | 65% | 0.648 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -74.7 | -9.3 | 177.2 | -176.3 | 177.1 | 163.4 | -157.5 | 0 | 113.6 | L594 E595 A596 | L594-K598 VanDerWaalsContact O-CB 3.28Å; L594-K598 WeakPolarHBondContact O-CB 3.46Å; L594-K598 PolarHBondContact O-N 2.89Å; E595-K598 WeakPolarHBondContact O-CB 3.44Å; E595-K598 PolarHBondContact O-N 3.09Å; E595-K598 WeakPolarHBondContact OE1-CD 3.42Å; E595-K598 WeakPolarHBondContact OE1-CE 3.45Å; E595-K598 IonicContact OE1-NZ 2.71Å; E595-K598 PolarHBondContact OE1-NZ 2.89Å; A596-K598 PolarHBondContact O-N 3.48Å |
| 599 | S | 56.6 | Low | 63.1 | Low | 78 Ų | 78 | 116.2 Ų | 116.2 | 55% | 0.545 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -96.7 | -37.1 | 176.3 | 79 | 0 | 0 | 0 | 0 | 113.7 | E595 A596 Q597 G601 | E595-S599 PolarHBondContact O-N 3.08Å; A596-S599 WeakPolarHBondContact O-CA 3.47Å; A596-S599 WeakPolarHBondContact O-CB 3.43Å; A596-S599 PolarHBondContact O-N 3.23Å; A596-S599 PolarHBondContact O-OG 2.94Å; Q597-S599 PolarHBondContact O-N 2.8Å; S599-G601 VanDerWaalsContact C-N 3.32Å; S599-G601 PolarHBondContact O-N 3.18Å |
| 600 | E | 52.1 | Low | 60.5 | Low | 141 Ų | 141 | 116.9 Ų | 116.9 | 66% | 0.659 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -69.3 | -29.1 | 179.4 | -67.2 | -167.6 | 124.1 | 0 | 0 | 112.7 | A596 K602 | A596-E600 PolarHBondContact O-N 3.49Å; E600-K602 PolarHBondContact O-N 2.85Å |
| 601 | G | 52.9 | Low | 58.3 | Low | 74 Ų | 74 | 117 Ų | 117 | 76% | 0.763 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | 24.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | S599 | S599-G601 VanDerWaalsContact C-N 3.32Å; S599-G601 PolarHBondContact O-N 3.18Å |
| 602 | K | 45.4 | Very low | 55.4 | Low | 190 Ų | 190 | 117.4 Ų | 117.4 | 83% | 0.826 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.8 | 3.1 | -169.3 | -117.6 | 176.3 | -178.2 | 178.8 | 0 | 116.6 | E600 | E600-K602 PolarHBondContact O-N 2.85Š|
| 603 | S | 41.4 | Very low | 52.8 | Low | 99 Ų | 99 | 115.9 Ų | 115.9 | 69% | 0.692 | 69% | 0.693 | S | S | * | * | trans | -119.4 | 60.3 | -175.5 | 60.9 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 604 | L | 40.2 | Very low | 51 | Low | 173 Ų | 173 | 114.7 Ų | 114.7 | 91% | 0.906 | 70% | 0.7 | S | S | * | * | trans | -139.7 | 116.7 | 163.4 | -75.8 | 179.1 | 0 | 0 | 0 | 110.7 | ||||
| 605 | P | 43.4 | Very low | 48.2 | Very low | 116 Ų | 116 | 114.3 Ų | 114.3 | 75% | 0.753 | 71% | 0.711 | S | S | * | * | trans | -95.1 | 143.9 | 178.7 | 35.3 | -32.8 | 0 | 0 | 0 | 113.9 | ||||
| 606 | S | 34 | Very low | 45.5 | Very low | 102 Ų | 102 | 115 Ų | 115 | 71% | 0.713 | 73% | 0.725 | S | S | * | * | trans | 45.9 | 106.5 | 151.2 | 59.2 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 607 | S | 36.3 | Very low | 43.2 | Very low | 116 Ų | 116 | 124 Ų | 124 | 81% | 0.811 | 75% | 0.749 | S | S | * | * | 36.4 | 160.8 | 100.7 | -48.7 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 608 | P | 55.5 | Low | 41.7 | Very low | 116 Ų | 116 | 127 Ų | 127 | 75% | 0.753 | 76% | 0.759 | S | S | * | * | cis | -131.7 | 169.5 | -13.3 | 38.5 | -22.6 | 0 | 0 | 0 | 114.6 | ||||
| 609 | S | 28 | Very low | 40 | Very low | 118 Ų | 118 | 125.2 Ų | 125.2 | 83% | 0.825 | 77% | 0.766 | S | S | * | * | 163.6 | 145.6 | 124.4 | 50.4 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 610 | S | 40.5 | Very low | 38.6 | Very low | 116 Ų | 116 | 128.5 Ų | 128.5 | 81% | 0.811 | 77% | 0.772 | S | S | * | * | trans | -115.2 | 155.4 | 161.3 | -46.6 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 611 | P | 47.1 | Very low | 37.3 | Very low | 111 Ų | 111 | 132.4 Ų | 132.4 | 72% | 0.721 | 78% | 0.781 | S | S | * | * | -155.5 | 170.4 | 87.2 | 40.4 | -22.6 | 0 | 0 | 0 | 116.8 | |||||
| 612 | S | 28.8 | Very low | 36 | Very low | 110 Ų | 110 | 137.7 Ų | 137.7 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | trans | 67.3 | 157.1 | 152.9 | 77.9 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 613 | S | 35.4 | Very low | 35.5 | Very low | 110 Ų | 110 | 132.8 Ų | 132.8 | 77% | 0.769 | 77% | 0.773 | S | S | * | * | cis | -176.1 | 178.6 | -12.1 | -105.4 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 614 | P | 51.4 | Low | 35.5 | Very low | 121 Ų | 121 | 133.8 Ų | 133.8 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | cis | -127 | -172 | -13.7 | 32.1 | -10.9 | 0 | 0 | 0 | 113.4 | ||||
| 615 | A | 28.2 | Very low | 35 | Very low | 92 Ų | 92 | 133 Ų | 133 | 76% | 0.76 | 77% | 0.773 | S | S | * | * | trans | -67.9 | 169.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 616 | C | 25.4 | Very low | 34.6 | Very low | 103 Ų | 103 | 131.5 Ų | 131.5 | 70% | 0.696 | 77% | 0.771 | S | S | * | * | 163.5 | 143.3 | 96.9 | -152 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 617 | R | 28.9 | Very low | 34.5 | Very low | 238 Ų | 238 | 133.9 Ų | 133.9 | 90% | 0.898 | 78% | 0.776 | S | S | * | * | trans | 71.4 | 171 | 155.9 | -78.7 | 157.7 | -165.4 | -127.5 | -0.7 | 119.8 | ||||
| 618 | K | 38.5 | Very low | 34.1 | Very low | 194 Ų | 194 | 135.6 Ų | 135.6 | 84% | 0.843 | 78% | 0.776 | S | S | * | * | trans | -110.1 | 175.4 | -164.1 | -58.6 | 179.3 | 177.2 | -178.3 | 0 | 111.2 | ||||
| 619 | S | 29.2 | Very low | 32.9 | Very low | 111 Ų | 111 | 136.7 Ų | 136.7 | 78% | 0.776 | 78% | 0.776 | S | S | * | * | trans | 76.8 | 151.5 | 167.1 | 84.2 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 620 | Q | 27.2 | Very low | 33 | Very low | 147 Ų | 147 | 135.8 Ų | 135.8 | 69% | 0.687 | 77% | 0.769 | S | S | * | * | cis | -174.8 | 153.6 | -15.1 | 156.7 | 173 | -24.2 | 0 | 0 | 109.4 | ||||
| 621 | W | 24.5 | Very low | 32.4 | Very low | 223 Ų | 223 | 136.4 Ų | 136.4 | 85% | 0.845 | 77% | 0.768 | S | S | * | * | trans | 66.1 | 173.6 | 176.1 | -66.1 | -1.7 | 0 | 0 | 0 | 116.4 | ||||
| 622 | K | 26.9 | Very low | 31.6 | Very low | 186 Ų | 186 | 134.7 Ų | 134.7 | 81% | 0.809 | 76% | 0.763 | S | S | * | * | cis | -170.6 | 152.2 | -48.6 | -166.3 | 176.7 | -179 | -171 | 0 | 107.6 | ||||
| 623 | S | 34.7 | Very low | 31.6 | Very low | 87 Ų | 87 | 139.1 Ų | 139.1 | 61% | 0.608 | 77% | 0.768 | S | S | * | * | trans | -64.3 | 156.8 | 170.7 | -168.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 624 | P | 42.3 | Very low | 31.3 | Very low | 120 Ų | 120 | 139.1 Ų | 139.1 | 78% | 0.779 | 77% | 0.769 | S | S | * | * | -140.7 | 150.5 | 108.8 | 38.5 | -26.7 | 0 | 0 | 0 | 116.3 | |||||
| 625 | D | 29.1 | Very low | 30.2 | Very low | 155 Ų | 155 | 142.9 Ų | 142.9 | 83% | 0.829 | 77% | 0.773 | S | S | * | * | trans | -90.2 | 151.2 | 153.3 | -62.2 | -80.1 | 0 | 0 | 0 | 110.2 | ||||
| 626 | A | 35.4 | Very low | 30.9 | Very low | 85 Ų | 85 | 144.8 Ų | 144.8 | 70% | 0.702 | 78% | 0.777 | S | S | * | * | trans | -177.6 | 147.2 | 168.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 627 | D | 31.1 | Very low | 30.9 | Very low | 152 Ų | 152 | 143.1 Ų | 143.1 | 81% | 0.813 | 78% | 0.777 | S | S | * | * | cis | -164.2 | -174.9 | -9.8 | -99.8 | -34.5 | 0 | 0 | 0 | 108.7 | ||||
| 628 | D | 27.6 | Very low | 30.9 | Very low | 152 Ų | 152 | 137.8 Ų | 137.8 | 81% | 0.813 | 77% | 0.771 | S | S | * | * | trans | 85.1 | 91.3 | 151.6 | -115.4 | -125.2 | 0 | 0 | 0 | 123.4 | ||||
| 629 | D | 30.2 | Very low | 30.5 | Very low | 140 Ų | 140 | 136 Ų | 136 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | 56.4 | 146.4 | 115 | -143.3 | -0.3 | 0 | 0 | 0 | 125.8 | |||||
| 630 | S | 29.9 | Very low | 30.4 | Very low | 98 Ų | 98 | 138.4 Ų | 138.4 | 69% | 0.685 | 77% | 0.765 | S | S | * | * | trans | 80.1 | 155 | 146.7 | 92.2 | 0 | 0 | 0 | 0 | 120 | ||||
| 631 | V | 28.6 | Very low | 30.5 | Very low | 130 Ų | 130 | 134.6 Ų | 134.6 | 79% | 0.788 | 76% | 0.764 | S | S | * | * | cis | -163 | 143 | -19.3 | 118.7 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 632 | A | 29.8 | Very low | 30.8 | Very low | 75 Ų | 75 | 130.8 Ų | 130.8 | 62% | 0.62 | 76% | 0.759 | S | S | * | * | trans | 55.4 | 139.7 | 151.2 | 0 | 0 | 0 | 0 | 0 | 126.6 | ||||
| 633 | K | 28.7 | Very low | 30.9 | Very low | 202 Ų | 202 | 130.4 Ų | 130.4 | 88% | 0.878 | 76% | 0.76 | S | S | * | * | trans | 68.7 | 151.8 | 140.9 | -73.6 | 166.9 | -173.9 | 174.4 | 0 | 119.2 | ||||
| 634 | S | 28.9 | Very low | 30.7 | Very low | 111 Ų | 111 | 132.6 Ų | 132.6 | 78% | 0.776 | 77% | 0.77 | S | S | * | * | cis | -162.2 | 159.4 | -3.8 | 38.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 635 | K | 29.8 | Very low | 30 | Very low | 200 Ų | 200 | 134.9 Ų | 134.9 | 87% | 0.87 | 77% | 0.774 | S | S | * | * | trans | -84.5 | -177.8 | 161 | -68.4 | -173 | 175.2 | -176.3 | 0 | 110.4 | ||||
| 636 | P | 43.1 | Very low | 29.9 | Very low | 132 Ų | 132 | 131.1 Ų | 131.1 | 86% | 0.857 | 77% | 0.772 | S | S | * | * | cis | -139 | -169.5 | 4.5 | 43.8 | -24.4 | 0 | 0 | 0 | 116.4 | ||||
| 637 | G | 25.7 | Very low | 29.5 | Very low | 68 Ų | 68 | 132.3 Ų | 132.3 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | trans | 144.8 | 114 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 638 | V | 28.7 | Very low | 29.3 | Very low | 126 Ų | 126 | 133 Ų | 133 | 76% | 0.764 | 78% | 0.778 | S | S | * | * | cis | 104 | 121.7 | 36.7 | 169.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 639 | Q | 28.6 | Very low | 29.2 | Very low | 155 Ų | 155 | 131.5 Ų | 131.5 | 72% | 0.724 | 78% | 0.78 | S | S | * | * | trans | 23.9 | 155.6 | 152.8 | -72.1 | 156.3 | -85.4 | 0 | 0 | 121 | ||||
| 640 | E | 27.3 | Very low | 29.1 | Very low | 163 Ų | 163 | 129.3 Ų | 129.3 | 76% | 0.762 | 78% | 0.781 | S | S | * | * | cis | -166 | -177.5 | 16 | -136.8 | 153.4 | -136.8 | 0 | 0 | 112.4 | ||||
| 641 | G | 29.5 | Very low | 29 | Very low | 66 Ų | 66 | 130.8 Ų | 130.8 | 68% | 0.68 | 79% | 0.791 | S | S | * | * | trans | 91.2 | 126.7 | 164.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 642 | I | 31.7 | Very low | 29.1 | Very low | 144 Ų | 144 | 130.5 Ų | 130.5 | 74% | 0.738 | 80% | 0.795 | S | S | * | * | cis | 101.5 | 103.5 | 23.5 | -61.6 | 174 | 0 | 0 | 0 | 114.5 | ||||
| 643 | Q | 28.9 | Very low | 29.1 | Very low | 178 Ų | 178 | 138.6 Ų | 138.6 | 83% | 0.832 | 81% | 0.81 | S | S | * | * | trans | 61.9 | 151.5 | 155.5 | -60.9 | 167.4 | 11.2 | 0 | 0 | 116.9 | ||||
| 644 | V | 29.7 | Very low | 29 | Very low | 132 Ų | 132 | 133.7 Ų | 133.7 | 80% | 0.8 | 81% | 0.807 | S | S | * | * | -156.9 | 172 | 54.7 | 159.9 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 645 | L | 28.2 | Very low | 29 | Very low | 168 Ų | 168 | 139.9 Ų | 139.9 | 88% | 0.88 | 81% | 0.813 | S | S | * | * | trans | -69.8 | 159 | -177.2 | -57.9 | 84.4 | 0 | 0 | 0 | 115.6 | ||||
| 646 | G | 26.6 | Very low | 29.3 | Very low | 76 Ų | 76 | 136.2 Ų | 136.2 | 78% | 0.784 | 81% | 0.81 | S | S | * | * | trans | -177.2 | 131.1 | 162.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 647 | S | 26.5 | Very low | 28.7 | Very low | 111 Ų | 111 | 140 Ų | 140 | 78% | 0.776 | 81% | 0.813 | S | S | * | * | trans | -117.3 | 163.2 | -164.9 | -57.1 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 648 | L | 26.6 | Very low | 29 | Very low | 166 Ų | 166 | 141.1 Ų | 141.1 | 87% | 0.869 | 82% | 0.815 | S | S | * | * | trans | 71.2 | 113 | 164.3 | -51.4 | 176.2 | 0 | 0 | 0 | 118.3 | ||||
| 649 | S | 26.9 | Very low | 29.3 | Very low | 121 Ų | 121 | 145 Ų | 145 | 85% | 0.846 | 82% | 0.822 | S | S | * | * | 169.7 | 157.7 | 100.2 | 51.1 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 650 | A | 28.3 | Very low | 29.4 | Very low | 94 Ų | 94 | 145.1 Ų | 145.1 | 78% | 0.777 | 83% | 0.827 | S | S | * | * | trans | 11 | 122.5 | 164.5 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 651 | S | 26.8 | Very low | 30.3 | Very low | 128 Ų | 128 | 145.1 Ų | 145.1 | 90% | 0.895 | 83% | 0.827 | S | S | * | * | trans | 33.6 | 107 | 131.7 | -163.6 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 652 | S | 30.3 | Very low | 31 | Very low | 124 Ų | 124 | 146.2 Ų | 146.2 | 87% | 0.867 | 82% | 0.818 | S | S | * | * | trans | -140.5 | 163.5 | 158.3 | 64.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 653 | R | 29.8 | Very low | 31.6 | Very low | 246 Ų | 246 | 143.9 Ų | 143.9 | 93% | 0.928 | 81% | 0.814 | S | S | * | * | trans | -104.1 | 156.4 | -163 | -167.2 | -179.9 | -170.2 | 171.9 | 4 | 112 | ||||
| 654 | A | 28.1 | Very low | 32.1 | Very low | 99 Ų | 99 | 138.9 Ų | 138.9 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | 81.2 | 135.6 | 168.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 655 | R | 27.2 | Very low | 33.1 | Very low | 241 Ų | 241 | 138.1 Ų | 138.1 | 91% | 0.909 | 78% | 0.779 | S | S | * | * | trans | -136.6 | 105.5 | 173.1 | -172.1 | -175.5 | -166.2 | -167.7 | 6.2 | 109.2 | ||||
| 656 | P | 36.4 | Very low | 34.2 | Very low | 122 Ų | 122 | 135.8 Ų | 135.8 | 79% | 0.792 | 77% | 0.766 | S | S | * | * | trans | -75.9 | 164.3 | 170.4 | 31.6 | -33.2 | 0 | 0 | 0 | 111.5 | ||||
| 657 | K | 30.4 | Very low | 35.1 | Very low | 213 Ų | 213 | 137.3 Ų | 137.3 | 93% | 0.926 | 76% | 0.756 | S | S | * | * | trans | -90.3 | 134.2 | -179.2 | -66.9 | 179.3 | 176.9 | 179.7 | 0 | 112.6 | ||||
| 658 | A | 32.2 | Very low | 36.2 | Very low | 91 Ų | 91 | 139.7 Ų | 139.7 | 75% | 0.752 | 75% | 0.748 | S | S | * | * | trans | -144 | 111.1 | 147.6 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 659 | K | 34.5 | Very low | 37.3 | Very low | 208 Ų | 208 | 139.2 Ų | 139.2 | 90% | 0.904 | 74% | 0.741 | S | S | * | * | 69.3 | 111.3 | 99.9 | -77.1 | -163.1 | 174.3 | -165.6 | 0 | 114 | |||||
| 660 | D | 31.8 | Very low | 38 | Very low | 156 Ų | 156 | 140.3 Ų | 140.3 | 83% | 0.834 | 74% | 0.736 | S | S | * | * | trans | -144.5 | 144.7 | 140.2 | -162 | 7.3 | 0 | 0 | 0 | 108.8 | ||||
| 661 | E | 46.8 | Very low | 38.8 | Very low | 163 Ų | 163 | 143 Ų | 143 | 76% | 0.762 | 74% | 0.737 | S | S | * | * | trans | -133.9 | 79.1 | -172.4 | -88.1 | -155.7 | 136.4 | 0 | 0 | 112.7 | K665 | E661-K665 PolarHBondContact O-NZ 3.02Š| ||
| 662 | D | 43.8 | Very low | 39 | Very low | 90 Ų | 90 | 139.9 Ų | 139.9 | 48% | 0.481 | 73% | 0.725 | S | S | . | * | trans | -144.3 | -9.4 | 165.1 | -117.7 | -43 | 0 | 0 | 0 | 118.2 | D664 K665 | D662-D664 PolarHBondContact O-N 3.23Å; D662-K665 PolarHBondContact O-N 3.2Å; D662-K665 WeakPolarHBondContact OD1-CD 3.46Å; D662-K665 WeakPolarHBondContact OD1-CE 3.46Å; D662-K665 WeakPolarHBondContact OD1-CG 3.02Å; D662-K665 IonicContact OD1-NZ 2.69Å; D662-K665 PolarHBondContact OD1-NZ 3.24Å; D662-K665 IonicContact OD2-NZ 2.93Å; D662-K665 PolarHBondContact OD2-NZ 2.9Å | ||
| 663 | S | 43.4 | Very low | 39.2 | Very low | 94 Ų | 94 | 143.1 Ų | 143.1 | 66% | 0.657 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -58.2 | -32.8 | 172.5 | 49.4 | 0 | 0 | 0 | 0 | 113.1 | K665 | S663-K665 PolarHBondContact O-N 3.37Å |
| 664 | D | 40.6 | Very low | 39.3 | Very low | 74 Ų | 74 | 140.6 Ų | 140.6 | 40% | 0.396 | 72% | 0.723 | S | S | . | * | H | α-helix | trans | -82.5 | -12.8 | -169.2 | -154.1 | 29.5 | 0 | 0 | 0 | 113.6 | D662 R668 | D662-D664 PolarHBondContact O-N 3.23Å; D664-R668 VanDerWaalsContact CG-NH2 3.25Å; D664-R668 VanDerWaalsContact O-CZ 3.24Å; D664-R668 PolarHBondContact O-NE 2.84Å; D664-R668 PolarHBondContact O-NH2 3.34Å; D664-R668 IonicContact OD1-CZ 3.84Å; D664-R668 IonicContact OD1-NH1 3.17Å; D664-R668 PolarHBondContact OD1-NH1 2.96Å; D664-R668 VanDerWaalsContact OD1-NH1 3.17Å; D664-R668 IonicContact OD1-NH2 3.99Å; D664-R668 IonicContact OD2-CZ 3.12Å; D664-R668 IonicContact OD2-NH1 2.7Å; D664-R668 PolarHBondContact OD2-NH1 3.46Å; D664-R668 IonicContact OD2-NH2 2.71Å; D664-R668 PolarHBondContact OD2-NH2 3.45Å |
| 665 | K | 50.1 | Low | 39.7 | Very low | 116 Ų | 116 | 143.7 Ų | 143.7 | 50% | 0.504 | 72% | 0.724 | S | S | . | * | H | α-helix | trans | -82 | -34.7 | 173.6 | -53.3 | -164 | -165.2 | 78.6 | 0 | 111.7 | E661 D662 S663 Q669 | E661-K665 PolarHBondContact O-NZ 3.02Å; D662-K665 PolarHBondContact O-N 3.2Å; D662-K665 WeakPolarHBondContact OD1-CD 3.46Å; D662-K665 WeakPolarHBondContact OD1-CE 3.46Å; D662-K665 WeakPolarHBondContact OD1-CG 3.02Å; D662-K665 IonicContact OD1-NZ 2.69Å; D662-K665 PolarHBondContact OD1-NZ 3.24Å; D662-K665 IonicContact OD2-NZ 2.93Å; D662-K665 PolarHBondContact OD2-NZ 2.9Å; S663-K665 PolarHBondContact O-N 3.37Å; K665-Q669 PolarHBondContact O-N 3.46Å |
| 666 | I | 50.5 | Low | 39.9 | Very low | 119 Ų | 119 | 137 Ų | 137 | 61% | 0.61 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -69.2 | -44.3 | 179 | -60.8 | 176.2 | 0 | 0 | 0 | 110.7 | R668 Q669 L670 | I666-R668 PolarHBondContact O-N 3.15Å; I666-Q669 PolarHBondContact O-N 3.2Å; I666-L670 PolarHBondContact O-N 2.83Å |
| 667 | L | 45.4 | Very low | 39.7 | Very low | 107 Ų | 107 | 139.5 Ų | 139.5 | 56% | 0.56 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -60.5 | -41.7 | 176.6 | -74.4 | 168.4 | 0 | 0 | 0 | 112.5 | Q669 L670 | L667-Q669 PolarHBondContact O-N 3.16Å; L667-L670 PolarHBondContact O-N 3.19Å |
| 668 | R | 50.4 | Low | 39.6 | Very low | 161 Ų | 161 | 136.7 Ų | 136.7 | 61% | 0.608 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -69.9 | -14.2 | 177.8 | -79.4 | -168.4 | -80 | -85 | 3.3 | 114.9 | D664 I666 | D664-R668 VanDerWaalsContact CG-NH2 3.25Å; D664-R668 VanDerWaalsContact O-CZ 3.24Å; D664-R668 PolarHBondContact O-NE 2.84Å; D664-R668 PolarHBondContact O-NH2 3.34Å; D664-R668 IonicContact OD1-CZ 3.84Å; D664-R668 IonicContact OD1-NH1 3.17Å; D664-R668 PolarHBondContact OD1-NH1 2.96Å; D664-R668 VanDerWaalsContact OD1-NH1 3.17Å; D664-R668 IonicContact OD1-NH2 3.99Å; D664-R668 IonicContact OD2-CZ 3.12Å; D664-R668 IonicContact OD2-NH1 2.7Å; D664-R668 PolarHBondContact OD2-NH1 3.46Å; D664-R668 IonicContact OD2-NH2 2.71Å; D664-R668 PolarHBondContact OD2-NH2 3.45Å; I666-R668 PolarHBondContact O-N 3.15Å |
| 669 | Q | 50.1 | Low | 39.3 | Very low | 156 Ų | 156 | 139.3 Ų | 139.3 | 73% | 0.729 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -92 | -21.9 | 177.7 | -170.4 | 53.5 | 79 | 0 | 0 | 113.4 | K665 I666 L667 | K665-Q669 PolarHBondContact O-N 3.46Å; I666-Q669 PolarHBondContact O-N 3.2Å; L667-Q669 PolarHBondContact O-N 3.16Å |
| 670 | L | 41.1 | Very low | 39 | Very low | 144 Ų | 144 | 134.2 Ų | 134.2 | 75% | 0.754 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -84.5 | -29.5 | 177.1 | -79.2 | 163.2 | 0 | 0 | 0 | 113.4 | I666 L667 G672 | I666-L670 PolarHBondContact O-N 2.83Å; L667-L670 PolarHBondContact O-N 3.19Å; L670-G672 VanDerWaalsContact C-N 3.25Å; L670-G672 PolarHBondContact O-N 3.19Å |
| 671 | L | 46.1 | Very low | 38.9 | Very low | 151 Ų | 151 | 133.1 Ų | 133.1 | 79% | 0.791 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -85.8 | 60.8 | 178.2 | -75.3 | 162.1 | 0 | 0 | 0 | 111.9 | K673 | L671-K673 PolarHBondContact O-N 3.38Š|
| 672 | G | 30.3 | Very low | 38 | Very low | 63 Ų | 63 | 132.2 Ų | 132.2 | 65% | 0.649 | 70% | 0.7 | S | S | * | * | trans | -74.2 | 79 | -170.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | L670 | L670-G672 VanDerWaalsContact C-N 3.25Å; L670-G672 PolarHBondContact O-N 3.19Å | ||
| 673 | K | 33.8 | Very low | 37.3 | Very low | 192 Ų | 192 | 135.8 Ų | 135.8 | 84% | 0.835 | 71% | 0.714 | S | S | * | * | trans | 58.2 | 115.2 | 153 | -63.3 | -178.1 | 176.4 | -179.4 | 0 | 119.6 | L671 | L671-K673 PolarHBondContact O-N 3.38Š| ||
| 674 | E | 32.4 | Very low | 37 | Very low | 193 Ų | 193 | 140.1 Ų | 140.1 | 90% | 0.902 | 72% | 0.721 | S | S | * | * | trans | -76.3 | 156.1 | 148.4 | -63 | -175.3 | 134.4 | 0 | 0 | 111.9 | ||||
| 675 | I | 36.7 | Very low | 36.3 | Very low | 164 Ų | 164 | 145 Ų | 145 | 84% | 0.841 | 75% | 0.747 | S | S | * | * | trans | -150.6 | 136.9 | 157.7 | -16 | 174.8 | 0 | 0 | 0 | 105.2 | ||||
| 676 | S | 31.2 | Very low | 35.2 | Very low | 99 Ų | 99 | 144.1 Ų | 144.1 | 69% | 0.692 | 76% | 0.755 | S | S | * | * | cis | -144.1 | 151.1 | 11.8 | -173.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 677 | E | 32.4 | Very low | 34.2 | Very low | 175 Ų | 175 | 145.7 Ų | 145.7 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | trans | -66.3 | 158.1 | 158.2 | -62.1 | 178.3 | 105.8 | 0 | 0 | 111 | ||||
| 678 | N | 29.2 | Very low | 33.3 | Very low | 155 Ų | 155 | 149.3 Ų | 149.3 | 83% | 0.829 | 78% | 0.778 | S | S | * | * | -179.6 | 108.3 | 128.8 | -95.8 | -38.3 | 0 | 0 | 0 | 112.2 | |||||
| 679 | V | 25.8 | Very low | 32.1 | Very low | 146 Ų | 146 | 150.9 Ų | 150.9 | 89% | 0.885 | 79% | 0.789 | S | S | * | * | trans | 166.1 | 122.1 | 131.3 | 154.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 680 | C | 28.3 | Very low | 31.1 | Very low | 100 Ų | 100 | 152.2 Ų | 152.2 | 68% | 0.676 | 80% | 0.795 | S | S | * | * | trans | -106.7 | 134.3 | 176.7 | 172.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 681 | T | 28.8 | Very low | 30.4 | Very low | 133 Ų | 133 | 152.6 Ų | 152.6 | 82% | 0.816 | 80% | 0.798 | S | S | * | * | trans | -149.4 | 131 | 140.7 | 47.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 682 | Q | 28.1 | Very low | 29.6 | Very low | 145 Ų | 145 | 150.5 Ų | 150.5 | 68% | 0.678 | 80% | 0.802 | S | S | * | * | trans | -58.3 | 172.5 | 153.7 | -73.3 | 150.9 | -110.8 | 0 | 0 | 110.1 | ||||
| 683 | E | 29.7 | Very low | 29.4 | Very low | 165 Ų | 165 | 156.5 Ų | 156.5 | 77% | 0.771 | 81% | 0.813 | S | S | * | * | cis | -158.1 | 175.2 | 27.2 | -156.9 | 128.9 | -122.6 | 0 | 0 | 114.6 | ||||
| 684 | K | 36.2 | Very low | 29.2 | Very low | 185 Ų | 185 | 151.2 Ų | 151.2 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -96.4 | 131.7 | 179.9 | 160 | -162.7 | 177.2 | -172.6 | 0 | 110.2 | ||||
| 685 | L | 25.1 | Very low | 28.9 | Very low | 177 Ų | 177 | 147.6 Ų | 147.6 | 93% | 0.927 | 80% | 0.802 | S | S | * | * | trans | -136.9 | 159.3 | 161.8 | -78.6 | -178 | 0 | 0 | 0 | 111.7 | ||||
| 686 | S | 28 | Very low | 28.5 | Very low | 96 Ų | 96 | 144.5 Ų | 144.5 | 67% | 0.671 | 80% | 0.795 | S | S | * | * | trans | -153.9 | 144.6 | -171.3 | -163.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 687 | L | 28.6 | Very low | 28.6 | Very low | 153 Ų | 153 | 150.1 Ų | 150.1 | 80% | 0.801 | 80% | 0.801 | S | S | * | * | trans | 63 | 157.9 | -172.1 | -64.5 | 101.1 | 0 | 0 | 0 | 113.2 | ||||
| 688 | E | 26.8 | Very low | 28.5 | Very low | 183 Ų | 183 | 148.5 Ų | 148.5 | 86% | 0.855 | 80% | 0.798 | S | S | * | * | cis | -153.1 | -176.2 | 29.7 | -154.5 | 157.1 | -159.4 | 0 | 0 | 113.4 | ||||
| 689 | F | 26.5 | Very low | 28.6 | Very low | 194 Ų | 194 | 145.4 Ų | 145.4 | 85% | 0.851 | 79% | 0.788 | S | S | * | * | trans | -93.3 | 139.5 | -179.4 | -113.9 | -106.5 | 0 | 0 | 0 | 111.8 | ||||
| 690 | Q | 28.2 | Very low | 29 | Very low | 184 Ų | 184 | 148 Ų | 148 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | 176 | 165.8 | 122.5 | -99.6 | 178.4 | 10.8 | 0 | 0 | 114.7 | |||||
| 691 | D | 27.3 | Very low | 29.8 | Very low | 152 Ų | 152 | 153 Ų | 153 | 81% | 0.813 | 80% | 0.798 | S | S | * | * | trans | -73.2 | 151.7 | -172 | -56 | -98.7 | 0 | 0 | 0 | 116.3 | ||||
| 692 | A | 27.5 | Very low | 30.4 | Very low | 106 Ų | 106 | 154.6 Ų | 154.6 | 88% | 0.876 | 80% | 0.8 | S | S | * | * | trans | -153.9 | 138.1 | 139.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 693 | Q | 27.8 | Very low | 31.4 | Very low | 189 Ų | 189 | 152 Ų | 152 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | trans | -68.8 | 164.9 | -176.8 | -87.1 | -89.3 | -1.6 | 0 | 0 | 116.2 | ||||
| 694 | A | 27.7 | Very low | 32.3 | Very low | 82 Ų | 82 | 151.9 Ų | 151.9 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | trans | 76.1 | 101 | 147.6 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 695 | S | 27.8 | Very low | 33.1 | Very low | 116 Ų | 116 | 150.1 Ų | 150.1 | 81% | 0.811 | 79% | 0.794 | S | S | * | * | 51.5 | 111.4 | 120.9 | 174.8 | 0 | 0 | 0 | 0 | 120.9 | |||||
| 696 | S | 28.3 | Very low | 34.3 | Very low | 99 Ų | 99 | 150.6 Ų | 150.6 | 69% | 0.692 | 79% | 0.789 | S | S | * | * | -178.1 | 138.5 | 98.2 | -166.4 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 697 | R | 32.4 | Very low | 35.3 | Very low | 217 Ų | 217 | 156.1 Ų | 156.1 | 82% | 0.819 | 80% | 0.795 | S | S | * | * | trans | 14.9 | 133.9 | 148.3 | -64.5 | 173.5 | -174.5 | 170.4 | 2.6 | 118.6 | ||||
| 698 | N | 30.1 | Very low | 36.5 | Very low | 141 Ų | 141 | 156.1 Ų | 156.1 | 75% | 0.754 | 79% | 0.79 | S | S | * | * | cis | -161.7 | 151.2 | 35.3 | -110.6 | -21.7 | 0 | 0 | 0 | 114.1 | ||||
| 699 | S | 30.7 | Very low | 37.9 | Very low | 91 Ų | 91 | 153.7 Ų | 153.7 | 64% | 0.636 | 78% | 0.783 | S | S | * | * | trans | 21.1 | 140.2 | 150.3 | 59.4 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 700 | K | 34.9 | Very low | 39.5 | Very low | 201 Ų | 201 | 152.3 Ų | 152.3 | 87% | 0.874 | 78% | 0.776 | S | S | * | * | cis | -164.9 | 121 | 2.3 | -107.6 | 163.2 | -173.8 | 175.2 | 0 | 109.8 | ||||
| 701 | K | 44.6 | Very low | 41 | Very low | 205 Ų | 205 | 147.9 Ų | 147.9 | 89% | 0.891 | 76% | 0.758 | S | S | * | * | trans | -151.6 | 130.1 | 159.8 | -79.2 | -173.2 | 178.7 | 178.8 | 0 | 107.6 | ||||
| 702 | I | 41.9 | Very low | 42.5 | Very low | 166 Ų | 166 | 143.2 Ų | 143.2 | 85% | 0.851 | 74% | 0.741 | S | S | * | * | trans | -165.9 | 148.2 | 172.3 | -111.8 | 146.9 | 0 | 0 | 0 | 109.9 | ||||
| 703 | P | 49.7 | Very low | 44.1 | Very low | 91 Ų | 91 | 147.7 Ų | 147.7 | 59% | 0.591 | 74% | 0.735 | S | S | * | * | -146.3 | -140.5 | -112.8 | 45.1 | -24.4 | 0 | 0 | 0 | 115 | E705 | P703-E705 PolarHBondContact O-N 3.13Š| |||
| 704 | L | 48.5 | Very low | 45.5 | Very low | 161 Ų | 161 | 143.8 Ų | 143.8 | 84% | 0.843 | 72% | 0.719 | S | S | * | * | trans | -67.6 | 73.7 | 178 | -67.6 | 77.5 | 0 | 0 | 0 | 113.5 | ||||
| 705 | E | 52 | Low | 46.9 | Very low | 148 Ų | 148 | 147.6 Ų | 147.6 | 69% | 0.692 | 72% | 0.716 | S | S | * | * | trans | -98.8 | -22.5 | 175 | -105.1 | 178.6 | 167.8 | 0 | 0 | 114.6 | P703 R707 | P703-E705 PolarHBondContact O-N 3.13Å; E705-R707 VanDerWaalsContact C-N 3.31Å; E705-R707 PolarHBondContact O-N 2.89Å | ||
| 706 | K | 50.4 | Low | 48.2 | Very low | 188 Ų | 188 | 148.6 Ų | 148.6 | 82% | 0.817 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.1 | -0.5 | -168.9 | -73.8 | -176.1 | 176.7 | 176.6 | 0 | 116.2 | ||
| 707 | R | 48.9 | Very low | 49.7 | Very low | 212 Ų | 212 | 150.2 Ų | 150.2 | 80% | 0.8 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.3 | -46.2 | -177.7 | -164.2 | 168.9 | -176.1 | 150.2 | 0.3 | 112.9 | E705 | E705-R707 VanDerWaalsContact C-N 3.31Å; E705-R707 PolarHBondContact O-N 2.89Å |
| 708 | E | 54.5 | Low | 50.8 | Low | 152 Ų | 152 | 147.3 Ų | 147.3 | 71% | 0.71 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -72.8 | -38.4 | -176.8 | -61.6 | -171.9 | 124 | 0 | 0 | 112.6 | K710 L711 A712 | E708-K710 PolarHBondContact O-N 3.46Å; E708-K710 VanDerWaalsContact O-N 3.08Å; E708-L711 WeakPolarHBondContact O-CA 3.28Å; E708-L711 WeakPolarHBondContact O-CB 3.12Å; E708-L711 PolarHBondContact O-N 3.12Å; E708-A712 PolarHBondContact O-N 3.15Å |
| 709 | L | 57.1 | Low | 51.6 | Low | 133 Ų | 133 | 148.7 Ų | 148.7 | 70% | 0.696 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -57.2 | -29 | 178.9 | -161 | 74.4 | 0 | 0 | 0 | 113.1 | R713 | L709-R713 WeakPolarHBondContact O-CB 3.35Å; L709-R713 PolarHBondContact O-N 3.14Å |
| 710 | K | 59.6 | Low | 52.1 | Low | 164 Ų | 164 | 154.2 Ų | 154.2 | 71% | 0.713 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -74.7 | -36.2 | 174.7 | -66.4 | -172.9 | 177.2 | -172.7 | 0 | 112.7 | E708 L714 | E708-K710 PolarHBondContact O-N 3.46Å; E708-K710 VanDerWaalsContact O-N 3.08Å; K710-L714 PolarHBondContact O-N 3.4Å |
| 711 | L | 59.8 | Low | 52.1 | Low | 91 Ų | 91 | 149.8 Ų | 149.8 | 48% | 0.476 | 71% | 0.709 | S | S | . | * | H | α-helix | trans | -72.8 | -34.8 | 176.9 | -102.3 | 157.6 | 0 | 0 | 0 | 112.3 | E708 R715 | E708-L711 WeakPolarHBondContact O-CA 3.28Å; E708-L711 WeakPolarHBondContact O-CB 3.12Å; E708-L711 PolarHBondContact O-N 3.12Å; L711-R715 PolarHBondContact O-N 3.27Å |
| 712 | A | 59.3 | Low | 51.6 | Low | 54 Ų | 54 | 147.9 Ų | 147.9 | 45% | 0.446 | 71% | 0.708 | S | S | . | * | H | α-helix | trans | -64.1 | -49.5 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | E708 L714 R715 Q716 | E708-A712 PolarHBondContact O-N 3.15Å; A712-L714 VanDerWaalsContact C-N 3.28Å; A712-L714 PolarHBondContact O-N 3.08Å; A712-R715 PolarHBondContact O-N 3.01Å; A712-Q716 PolarHBondContact O-N 3.12Å |
| 713 | R | 60.6 | Low | 51 | Low | 201 Ų | 201 | 145.1 Ų | 145.1 | 76% | 0.758 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -64.4 | -29.1 | -176.7 | -160.2 | 172.4 | -168.5 | 165.8 | 3.6 | 113.7 | L709 L717 | L709-R713 WeakPolarHBondContact O-CB 3.35Å; L709-R713 PolarHBondContact O-N 3.14Å; R713-L717 PolarHBondContact O-N 3.06Å |
| 714 | L | 57.6 | Low | 50.2 | Low | 106 Ų | 106 | 149.6 Ų | 149.6 | 56% | 0.555 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -70.9 | -45 | 174.1 | -175.1 | 62.5 | 0 | 0 | 0 | 112 | K710 A712 Q716 L717 M718 | K710-L714 PolarHBondContact O-N 3.4Å; A712-L714 VanDerWaalsContact C-N 3.28Å; A712-L714 PolarHBondContact O-N 3.08Å; L714-Q716 VanDerWaalsContact C-N 3.34Å; L714-Q716 PolarHBondContact O-N 2.99Å; L714-L717 PolarHBondContact O-N 3.2Å; L714-M718 PolarHBondContact O-N 3.15Å |
| 715 | R | 57.2 | Low | 49.3 | Very low | 163 Ų | 163 | 146.3 Ų | 146.3 | 62% | 0.615 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -62.5 | -40.9 | 176.9 | -71 | -177.8 | 175.6 | 115.9 | -4.8 | 112.1 | L711 A712 L717 M718 Q719 | L711-R715 PolarHBondContact O-N 3.27Å; A712-R715 PolarHBondContact O-N 3.01Å; R715-L717 PolarHBondContact O-N 3.46Å; R715-M718 PolarHBondContact O-N 2.72Å; R715-Q719 PolarHBondContact O-N 3Å |
| 716 | Q | 54.9 | Low | 48.2 | Very low | 137 Ų | 137 | 145.6 Ų | 145.6 | 64% | 0.64 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -66.7 | -22.3 | 179.4 | -163.3 | 173 | 23.2 | 0 | 0 | 113.5 | A712 L714 | A712-Q716 PolarHBondContact O-N 3.12Å; L714-Q716 VanDerWaalsContact C-N 3.34Å; L714-Q716 PolarHBondContact O-N 2.99Å |
| 717 | L | 60 | Low | 47.3 | Very low | 132 Ų | 132 | 142.2 Ų | 142.2 | 69% | 0.691 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -79.6 | -32.2 | 175.5 | -170.9 | 63.9 | 0 | 0 | 0 | 112.4 | R713 L714 R715 | R713-L717 PolarHBondContact O-N 3.06Å; L714-L717 PolarHBondContact O-N 3.2Å; R715-L717 PolarHBondContact O-N 3.46Å |
| 718 | M | 53.6 | Low | 46.2 | Very low | 157 Ų | 157 | 138.5 Ų | 138.5 | 77% | 0.773 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -80.6 | -11.8 | -178.8 | -65.1 | -175.8 | 71.1 | 0 | 0 | 114.2 | L714 R715 | L714-M718 PolarHBondContact O-N 3.15Å; R715-M718 PolarHBondContact O-N 2.72Å |
| 719 | Q | 47.6 | Very low | 45.1 | Very low | 169 Ų | 169 | 135.7 Ų | 135.7 | 79% | 0.79 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.9 | 20.6 | -177.2 | -70.6 | -175.1 | -43.6 | 0 | 0 | 114.1 | R715 | R715-Q719 PolarHBondContact O-N 3Š|
| 720 | R | 40.7 | Very low | 43.5 | Very low | 208 Ų | 208 | 136.7 Ų | 136.7 | 79% | 0.785 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -136.1 | 39.6 | -169.4 | -146.5 | 177.9 | -169.2 | 84.4 | 4.5 | 114.9 | ||
| 721 | S | 35.9 | Very low | 41.9 | Very low | 108 Ų | 108 | 135.8 Ų | 135.8 | 76% | 0.755 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -149.7 | 36.4 | -179.5 | -53.6 | 0 | 0 | 0 | 0 | 114.2 | ||
| 722 | L | 33.1 | Very low | 40.3 | Very low | 165 Ų | 165 | 134.9 Ų | 134.9 | 86% | 0.864 | 71% | 0.706 | S | S | * | * | trans | -143.1 | 145.8 | 164.7 | -69.5 | 176.6 | 0 | 0 | 0 | 108.3 | ||||
| 723 | S | 30.3 | Very low | 38.9 | Very low | 107 Ų | 107 | 141.1 Ų | 141.1 | 75% | 0.748 | 73% | 0.726 | S | S | * | * | trans | 54.9 | 141.5 | 178.8 | 51.8 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 724 | E | 32 | Very low | 37.7 | Very low | 186 Ų | 186 | 138.2 Ų | 138.2 | 87% | 0.869 | 73% | 0.725 | S | S | * | * | cis | -159.8 | -168.6 | -22.3 | -123.8 | 152.5 | 162.9 | 0 | 0 | 110.4 | ||||
| 725 | S | 29.2 | Very low | 36.9 | Very low | 92 Ų | 92 | 138.1 Ų | 138.1 | 64% | 0.643 | 73% | 0.732 | S | S | * | * | trans | -61.4 | 158.6 | -178.2 | 53.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 726 | D | 29.1 | Very low | 35.6 | Very low | 133 Ų | 133 | 138.8 Ų | 138.8 | 71% | 0.711 | 74% | 0.739 | S | S | * | * | -173.7 | 168.2 | 69.4 | -109.3 | -54.8 | 0 | 0 | 0 | 117 | |||||
| 727 | T | 31.9 | Very low | 34.3 | Very low | 116 Ų | 116 | 139.6 Ų | 139.6 | 71% | 0.712 | 75% | 0.747 | S | S | * | * | trans | 48.3 | 137.2 | 153.5 | 55.5 | 0 | 0 | 0 | 0 | 126.3 | ||||
| 728 | D | 26 | Very low | 32.6 | Very low | 135 Ų | 135 | 139.5 Ų | 139.5 | 72% | 0.722 | 75% | 0.752 | S | S | * | * | trans | 72.1 | 108.9 | 139.2 | -84.4 | -61.9 | 0 | 0 | 0 | 125.2 | ||||
| 729 | S | 30.8 | Very low | 31.8 | Very low | 92 Ų | 92 | 137.3 Ų | 137.3 | 64% | 0.643 | 75% | 0.75 | S | S | * | * | 58.6 | 122.8 | 113.3 | -60.2 | 0 | 0 | 0 | 0 | 122.7 | |||||
| 730 | N | 24.5 | Very low | 30.8 | Very low | 154 Ų | 154 | 134.8 Ų | 134.8 | 82% | 0.824 | 75% | 0.746 | S | S | * | * | trans | 40.3 | 125 | 145.8 | -63.2 | -27 | 0 | 0 | 0 | 118.6 | ||||
| 731 | N | 25.3 | Very low | 30.2 | Very low | 145 Ų | 145 | 135 Ų | 135 | 78% | 0.775 | 75% | 0.747 | S | S | * | * | -165.4 | 174.8 | 66.8 | -150.9 | 4.4 | 0 | 0 | 0 | 115.4 | |||||
| 732 | S | 27.5 | Very low | 30 | Very low | 73 Ų | 73 | 139 Ų | 139 | 51% | 0.51 | 75% | 0.75 | S | S | . | * | trans | -20.9 | 155.5 | 152.5 | 68.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 733 | E | 28.3 | Very low | 29.9 | Very low | 184 Ų | 184 | 135.2 Ų | 135.2 | 86% | 0.86 | 74% | 0.743 | S | S | * | * | cis | -171.4 | 167.4 | -5.6 | -114.9 | -174 | 129.3 | 0 | 0 | 109.6 | ||||
| 734 | D | 35.9 | Very low | 29.6 | Very low | 140 Ų | 140 | 137.6 Ų | 137.6 | 75% | 0.749 | 75% | 0.747 | S | S | * | * | trans | -51.4 | 155.8 | 151.8 | -93.3 | -71.8 | 0 | 0 | 0 | 111.9 | ||||
| 735 | P | 41.3 | Very low | 29.4 | Very low | 105 Ų | 105 | 139.8 Ų | 139.8 | 68% | 0.682 | 75% | 0.748 | S | S | * | * | -156.9 | 167 | 51.3 | 40.6 | -19.5 | 0 | 0 | 0 | 118 | |||||
| 736 | K | 29.1 | Very low | 29.6 | Very low | 176 Ų | 176 | 140.7 Ų | 140.7 | 77% | 0.765 | 75% | 0.752 | S | S | * | * | trans | 176.1 | 112 | 133.5 | -95.2 | 145.3 | -165 | 158.4 | 0 | 112.3 | ||||
| 737 | N | 28.2 | Very low | 29.9 | Very low | 154 Ų | 154 | 143.8 Ų | 143.8 | 82% | 0.824 | 75% | 0.753 | S | S | * | * | 162.4 | 112 | 113.2 | -82.8 | -36.2 | 0 | 0 | 0 | 111.7 | |||||
| 738 | T | 24.7 | Very low | 30.2 | Very low | 130 Ų | 130 | 144.5 Ų | 144.5 | 80% | 0.798 | 76% | 0.76 | S | S | * | * | trans | -86.8 | 162 | 143.6 | 55.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 739 | P | 36.4 | Very low | 30.5 | Very low | 111 Ų | 111 | 143.7 Ų | 143.7 | 72% | 0.721 | 75% | 0.752 | S | S | * | * | -138.4 | 138.5 | 109.7 | 41.7 | -30.5 | 0 | 0 | 0 | 111.3 | |||||
| 740 | V | 26 | Very low | 31.1 | Very low | 117 Ų | 117 | 144.3 Ų | 144.3 | 71% | 0.709 | 75% | 0.754 | S | S | * | * | 65.8 | 127.1 | 100.9 | 170.5 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 741 | R | 29.5 | Very low | 31.3 | Very low | 212 Ų | 212 | 144.3 Ų | 144.3 | 80% | 0.8 | 75% | 0.752 | S | S | * | * | cis | -172.9 | 180 | 4.1 | -115.2 | -176.4 | -157.3 | -171.1 | 5.5 | 109.9 | ||||
| 742 | K | 30.4 | Very low | 31.6 | Very low | 191 Ų | 191 | 142.9 Ų | 142.9 | 83% | 0.83 | 75% | 0.748 | S | S | * | * | trans | 77 | 125.2 | 166.1 | -65.8 | 157.8 | -178.7 | -176.8 | 0 | 113.6 | ||||
| 743 | A | 30.7 | Very low | 31.6 | Very low | 86 Ų | 86 | 147 Ų | 147 | 71% | 0.711 | 76% | 0.759 | S | S | * | * | 78.9 | 131.4 | 62.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 744 | D | 25.2 | Very low | 31.7 | Very low | 157 Ų | 157 | 142.8 Ų | 142.8 | 84% | 0.84 | 75% | 0.751 | S | S | * | * | cis | -127.7 | 155 | 30 | -93.8 | -39.9 | 0 | 0 | 0 | 118.5 | ||||
| 745 | R | 28.2 | Very low | 31.6 | Very low | 232 Ų | 232 | 141.9 Ų | 141.9 | 88% | 0.875 | 75% | 0.75 | S | S | * | * | trans | -92.2 | 143.1 | 146.1 | -82.7 | 176 | 167.7 | 169.1 | -4.3 | 106.6 | ||||
| 746 | P | 32.9 | Very low | 31.2 | Very low | 112 Ų | 112 | 145.1 Ų | 145.1 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | -143.3 | 148 | 84.1 | 43 | -28.8 | 0 | 0 | 0 | 112.3 | |||||
| 747 | R | 34.2 | Very low | 31.1 | Very low | 197 Ų | 197 | 141.3 Ų | 141.3 | 74% | 0.743 | 75% | 0.752 | S | S | * | * | 49.5 | 105.2 | 69.8 | -148.4 | 173.3 | -158.9 | -163.6 | 4.7 | 111.2 | |||||
| 748 | P | 38.7 | Very low | 31.1 | Very low | 131 Ų | 131 | 141.3 Ų | 141.3 | 85% | 0.851 | 75% | 0.748 | S | S | * | * | -114.8 | 142.4 | 81 | -8.1 | 27.7 | 0 | 0 | 0 | 115.1 | |||||
| 749 | Q | 32.8 | Very low | 31 | Very low | 118 Ų | 118 | 142 Ų | 142 | 55% | 0.551 | 75% | 0.747 | S | S | * | * | trans | -81.2 | 159.5 | 150.1 | -107.3 | 171.2 | -31.7 | 0 | 0 | 107.6 | ||||
| 750 | P | 44.2 | Very low | 30.5 | Very low | 105 Ų | 105 | 142.1 Ų | 142.1 | 68% | 0.682 | 75% | 0.751 | S | S | * | * | -148.5 | 166.4 | 53.7 | 40.4 | -20.8 | 0 | 0 | 0 | 118.8 | |||||
| 751 | I | 28.8 | Very low | 30.7 | Very low | 154 Ų | 154 | 140.6 Ų | 140.6 | 79% | 0.79 | 75% | 0.75 | S | S | * | * | S | Bend | trans | 64.8 | 114.5 | 144.8 | -73.4 | 164.6 | 0 | 0 | 0 | 116.1 | ||
| 752 | V | 31.6 | Very low | 30.6 | Very low | 115 Ų | 115 | 139.4 Ų | 139.4 | 70% | 0.697 | 75% | 0.754 | S | S | * | * | cis | -148.5 | 126.9 | 7.6 | -170.6 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 753 | E | 27.5 | Very low | 30.5 | Very low | 159 Ų | 159 | 135 Ų | 135 | 74% | 0.743 | 75% | 0.748 | S | S | * | * | 60.5 | 147.4 | 75.2 | -80.1 | 170.2 | -170.4 | 0 | 0 | 115.2 | |||||
| 754 | S | 29.4 | Very low | 30.4 | Very low | 97 Ų | 97 | 137.5 Ų | 137.5 | 68% | 0.678 | 75% | 0.748 | S | S | * | * | cis | -177.7 | 140.1 | -32.6 | 40.7 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 755 | V | 34.6 | Very low | 30.6 | Very low | 121 Ų | 121 | 137.4 Ų | 137.4 | 73% | 0.733 | 74% | 0.742 | S | S | * | * | cis | 94.7 | 109.2 | 41.4 | 170.4 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 756 | E | 31.6 | Very low | 30.9 | Very low | 172 Ų | 172 | 132.6 Ų | 132.6 | 80% | 0.804 | 73% | 0.733 | S | S | * | * | trans | 65 | 145.4 | 145.6 | -70.3 | 171 | -175.1 | 0 | 0 | 125.7 | ||||
| 757 | S | 28.6 | Very low | 30.8 | Very low | 97 Ų | 97 | 133.8 Ų | 133.8 | 68% | 0.678 | 73% | 0.731 | S | S | * | * | trans | 90.4 | 152.3 | 137 | 75.7 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 758 | M | 27.6 | Very low | 30.7 | Very low | 153 Ų | 153 | 131.2 Ų | 131.2 | 75% | 0.754 | 73% | 0.73 | S | S | * | * | trans | 68.8 | 137.8 | 149.4 | -107.1 | 90.7 | 87.5 | 0 | 0 | 124.1 | ||||
| 759 | D | 22.4 | Very low | 30.2 | Very low | 144 Ų | 144 | 133 Ų | 133 | 77% | 0.77 | 72% | 0.724 | S | S | * | * | trans | 54.2 | 139.7 | 134 | -64.4 | -10 | 0 | 0 | 0 | 125.3 | ||||
| 760 | S | 26.8 | Very low | 29.9 | Very low | 114 Ų | 114 | 135.5 Ų | 135.5 | 80% | 0.797 | 73% | 0.734 | S | S | * | * | trans | 24.3 | 127.3 | 136.7 | -146.7 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 761 | A | 28.6 | Very low | 29.1 | Very low | 85 Ų | 85 | 138.7 Ų | 138.7 | 70% | 0.702 | 74% | 0.739 | S | S | * | * | trans | 79.9 | 138.7 | 139.3 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 762 | E | 27.7 | Very low | 29 | Very low | 188 Ų | 188 | 137.1 Ų | 137.1 | 88% | 0.879 | 74% | 0.737 | S | S | * | * | trans | 67.7 | 121.2 | 144.9 | -75.5 | -171.6 | -179.4 | 0 | 0 | 123.9 | ||||
| 763 | S | 28.2 | Very low | 28.8 | Very low | 99 Ų | 99 | 139.4 Ų | 139.4 | 69% | 0.692 | 74% | 0.744 | S | S | * | * | 81.8 | 93.6 | 128.8 | -143.9 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 764 | L | 28.8 | Very low | 29 | Very low | 137 Ų | 137 | 136 Ų | 136 | 72% | 0.717 | 74% | 0.743 | S | S | * | * | 62.1 | 119.1 | 125.5 | -57.9 | 178.4 | 0 | 0 | 0 | 121.3 | |||||
| 765 | H | 29.9 | Very low | 29 | Very low | 155 Ų | 155 | 137.6 Ų | 137.6 | 72% | 0.718 | 76% | 0.755 | S | S | * | * | 101.2 | 134.6 | 118.5 | -90.2 | 29.2 | 0 | 0 | 0 | 122 | |||||
| 766 | L | 35.1 | Very low | 28.6 | Very low | 132 Ų | 132 | 135.3 Ų | 135.3 | 69% | 0.691 | 76% | 0.756 | S | S | * | * | trans | 67.6 | 147.9 | 154.4 | -87.7 | 67 | 0 | 0 | 0 | 118.3 | ||||
| 767 | M | 29.9 | Very low | 28.5 | Very low | 136 Ų | 136 | 130.7 Ų | 130.7 | 67% | 0.67 | 75% | 0.754 | S | S | * | * | cis | -165.2 | 161.1 | -26.6 | -134.9 | -158.3 | -65.3 | 0 | 0 | 109.6 | ||||
| 768 | I | 31.4 | Very low | 28.7 | Very low | 144 Ų | 144 | 137.7 Ų | 137.7 | 74% | 0.738 | 77% | 0.765 | S | S | * | * | trans | 69.7 | 153.4 | 152.8 | -74.3 | 165.8 | 0 | 0 | 0 | 117.3 | ||||
| 769 | K | 28.1 | Very low | 28.6 | Very low | 167 Ų | 167 | 141.7 Ų | 141.7 | 73% | 0.726 | 77% | 0.772 | S | S | * | * | cis | -178.5 | 151.4 | -32.2 | -161.3 | 177.2 | -176.2 | 167.9 | 0 | 108.9 | ||||
| 770 | K | 27.7 | Very low | 29.2 | Very low | 172 Ų | 172 | 144 Ų | 144 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | trans | 71.5 | 164.1 | 167.9 | -53.9 | -161.1 | 176.9 | -177.8 | 0 | 116.8 | ||||
| 771 | H | 27.9 | Very low | 30 | Very low | 171 Ų | 171 | 144 Ų | 144 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | cis | -173.7 | 179.2 | -44.9 | -98.1 | -54.3 | 0 | 0 | 0 | 108.8 | ||||
| 772 | T | 25.7 | Very low | 30 | Very low | 121 Ų | 121 | 148.8 Ų | 148.8 | 74% | 0.742 | 78% | 0.778 | S | S | * | * | trans | 84.1 | 102.3 | 163.9 | -44.8 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 773 | L | 27.8 | Very low | 29.9 | Very low | 163 Ų | 163 | 144 Ų | 144 | 85% | 0.853 | 77% | 0.766 | S | S | * | * | 70.4 | 142.9 | 75.6 | -64.7 | 169.2 | 0 | 0 | 0 | 114 | |||||
| 774 | A | 32.3 | Very low | 29.9 | Very low | 88 Ų | 88 | 145.6 Ų | 145.6 | 73% | 0.727 | 77% | 0.765 | S | S | * | * | cis | -173.9 | -177.6 | -13.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 775 | S | 28.5 | Very low | 29.7 | Very low | 131 Ų | 131 | 147.5 Ų | 147.5 | 92% | 0.916 | 77% | 0.768 | S | S | * | * | trans | 100 | 129.6 | 163.6 | -156.8 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 776 | G | 26.8 | Very low | 29.5 | Very low | 73 Ų | 73 | 146.2 Ų | 146.2 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | cis | 170.8 | 155.4 | -10.8 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 777 | G | 29.3 | Very low | 29.2 | Very low | 74 Ų | 74 | 144.5 Ų | 144.5 | 76% | 0.763 | 77% | 0.77 | S | S | * | * | trans | 90 | 144.1 | 158.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 778 | R | 32.4 | Very low | 29.1 | Very low | 244 Ų | 244 | 147.8 Ų | 147.8 | 92% | 0.921 | 78% | 0.78 | S | S | * | * | cis | -155.1 | 160.8 | -2.1 | -48.8 | 178.2 | -170.3 | -159.4 | 2.6 | 107.2 | ||||
| 779 | R | 25.9 | Very low | 28.8 | Very low | 237 Ų | 237 | 145.6 Ų | 145.6 | 89% | 0.894 | 78% | 0.778 | S | S | * | * | cis | -164.6 | 149.7 | -24.6 | -106.3 | -166.1 | -172.5 | -175.6 | 4.7 | 106.6 | ||||
| 780 | F | 33.9 | Very low | 28.9 | Very low | 194 Ų | 194 | 144.2 Ų | 144.2 | 85% | 0.851 | 78% | 0.778 | S | S | * | * | trans | -82.1 | 177 | 166.1 | -66.8 | -96 | 0 | 0 | 0 | 111.6 | ||||
| 781 | P | 43.4 | Very low | 28.8 | Very low | 114 Ų | 114 | 143.1 Ų | 143.1 | 74% | 0.74 | 78% | 0.78 | S | S | * | * | -150.5 | 134.5 | 91.9 | 36.7 | -17.5 | 0 | 0 | 0 | 118.5 | |||||
| 782 | F | 29.2 | Very low | 28.8 | Very low | 184 Ų | 184 | 137.9 Ų | 137.9 | 81% | 0.807 | 77% | 0.772 | S | S | * | * | 45.4 | 127.5 | 123.7 | -68.9 | -66.3 | 0 | 0 | 0 | 125 | |||||
| 783 | S | 25.3 | Very low | 29.1 | Very low | 89 Ų | 89 | 141.3 Ų | 141.3 | 62% | 0.622 | 78% | 0.779 | S | S | * | * | 88.4 | 133.8 | 113.3 | -72.5 | 0 | 0 | 0 | 0 | 126.1 | |||||
| 784 | I | 28.4 | Very low | 29.3 | Very low | 131 Ų | 131 | 138.8 Ų | 138.8 | 67% | 0.672 | 78% | 0.775 | S | S | * | * | 79.2 | 110.2 | 124.9 | -67.6 | 171.6 | 0 | 0 | 0 | 121.7 | |||||
| 785 | K | 25.7 | Very low | 30.4 | Very low | 178 Ų | 178 | 140.6 Ų | 140.6 | 77% | 0.774 | 78% | 0.779 | S | S | * | * | trans | 58.1 | 163.1 | 136 | -56 | 175.4 | -163.6 | 170.3 | 0 | 122.3 | ||||
| 786 | T | 24.4 | Very low | 30.7 | Very low | 128 Ų | 128 | 139.4 Ų | 139.4 | 79% | 0.785 | 77% | 0.771 | S | S | * | * | trans | 67.8 | 157.1 | 155.2 | 48 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 787 | S | 29.4 | Very low | 32.2 | Very low | 95 Ų | 95 | 141.4 Ų | 141.4 | 66% | 0.664 | 77% | 0.771 | S | S | * | * | cis | -179.4 | 152.9 | -29.9 | -93.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 788 | K | 27.3 | Very low | 32.2 | Very low | 205 Ų | 205 | 143.3 Ų | 143.3 | 89% | 0.891 | 77% | 0.768 | S | S | * | * | trans | 67.7 | 160.5 | 160.8 | -72.6 | 173.1 | -177.8 | -175.8 | 0 | 115.3 | ||||
| 789 | S | 26.1 | Very low | 32.3 | Very low | 98 Ų | 98 | 136 Ų | 136 | 69% | 0.685 | 75% | 0.754 | S | S | * | * | cis | -169.8 | 170.6 | -17.4 | 176.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 790 | L | 28.6 | Very low | 32.4 | Very low | 139 Ų | 139 | 132.4 Ų | 132.4 | 73% | 0.728 | 75% | 0.748 | S | S | * | * | trans | 86.8 | 142.5 | 160.3 | -115.2 | 69.4 | 0 | 0 | 0 | 119.6 | ||||
| 791 | D | 26.4 | Very low | 32.1 | Very low | 148 Ų | 148 | 127.7 Ų | 127.7 | 79% | 0.791 | 74% | 0.739 | S | S | * | * | trans | 56.2 | 147.4 | 162.8 | -50.3 | -35.3 | 0 | 0 | 0 | 120.3 | ||||
| 792 | G | 28.2 | Very low | 31.5 | Very low | 61 Ų | 61 | 128 Ų | 128 | 63% | 0.629 | 74% | 0.744 | S | S | * | * | cis | 173 | 153.2 | -8.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 793 | H | 31.4 | Very low | 31.5 | Very low | 194 Ų | 194 | 128.1 Ų | 128.1 | 90% | 0.898 | 75% | 0.746 | S | S | * | * | trans | 67.9 | 117.6 | 165.7 | -62.4 | -77.4 | 0 | 0 | 0 | 121.7 | ||||
| 794 | S | 32.6 | Very low | 32.6 | Very low | 110 Ų | 110 | 128.9 Ų | 128.9 | 77% | 0.769 | 75% | 0.75 | S | S | * | * | trans | -83.3 | -175.3 | 152.6 | -45.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 795 | P | 54.7 | Low | 32.7 | Very low | 125 Ų | 125 | 129.8 Ų | 129.8 | 81% | 0.812 | 76% | 0.756 | S | S | * | * | -149.5 | 168.6 | 82 | 39.2 | -20.7 | 0 | 0 | 0 | 117.2 | |||||
| 796 | S | 35.4 | Very low | 33 | Very low | 107 Ų | 107 | 128.4 Ų | 128.4 | 75% | 0.748 | 76% | 0.756 | S | S | * | * | trans | -90.3 | -168.1 | 163.5 | -49.8 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 797 | P | 57.3 | Low | 33.1 | Very low | 115 Ų | 115 | 130.4 Ų | 130.4 | 75% | 0.747 | 76% | 0.756 | S | S | * | * | -146 | -167.9 | 85.5 | 40.6 | -21.5 | 0 | 0 | 0 | 112.4 | |||||
| 798 | T | 29.3 | Very low | 33.2 | Very low | 113 Ų | 113 | 130 Ų | 130 | 69% | 0.693 | 75% | 0.753 | S | S | * | * | cis | -156.2 | 140.9 | 11.5 | -8 | 0 | 0 | 0 | 0 | 108 | ||||
| 799 | S | 34.5 | Very low | 33.2 | Very low | 90 Ų | 90 | 128.9 Ų | 128.9 | 63% | 0.629 | 75% | 0.752 | S | S | * | * | 68.6 | 154.1 | 108.8 | -75 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 800 | E | 27.9 | Very low | 33.5 | Very low | 163 Ų | 163 | 134.7 Ų | 134.7 | 76% | 0.762 | 76% | 0.76 | S | S | * | * | cis | -159.6 | 141.6 | -3.8 | -114.9 | 159 | 120.2 | 0 | 0 | 108.4 | ||||
| 801 | S | 28.1 | Very low | 34.4 | Very low | 95 Ų | 95 | 134 Ų | 134 | 66% | 0.664 | 76% | 0.764 | S | S | * | * | 100.1 | 126.5 | 97.5 | 72.5 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 802 | S | 30.9 | Very low | 34.5 | Very low | 121 Ų | 121 | 130 Ų | 130 | 85% | 0.846 | 76% | 0.758 | S | S | * | * | trans | 63 | 138.1 | 137.1 | -49.3 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 803 | E | 30.3 | Very low | 34.6 | Very low | 185 Ų | 185 | 133.6 Ų | 133.6 | 86% | 0.864 | 77% | 0.773 | S | S | * | * | trans | -75.1 | -176.4 | 151 | -66.1 | -166.3 | 138 | 0 | 0 | 110.7 | ||||
| 804 | P | 48.8 | Very low | 34.4 | Very low | 106 Ų | 106 | 127.4 Ų | 127.4 | 69% | 0.688 | 76% | 0.761 | S | S | * | * | cis | -149.1 | 179.3 | 13 | 47.5 | -27.8 | 0 | 0 | 0 | 120 | ||||
| 805 | D | 29 | Very low | 34.2 | Very low | 149 Ų | 149 | 128.2 Ų | 128.2 | 80% | 0.797 | 77% | 0.767 | S | S | * | * | trans | 72.6 | 164.9 | 139.8 | -117.3 | -45.6 | 0 | 0 | 0 | 124.8 | ||||
| 806 | L | 32.5 | Very low | 32.8 | Very low | 149 Ų | 149 | 128.6 Ų | 128.6 | 78% | 0.78 | 77% | 0.768 | S | S | * | * | trans | 75.2 | 145.8 | 175.7 | -58.9 | 119 | 0 | 0 | 0 | 116.5 | ||||
| 807 | E | 27.4 | Very low | 34.1 | Very low | 170 Ų | 170 | 129 Ų | 129 | 79% | 0.794 | 77% | 0.767 | S | S | * | * | cis | -144.7 | 171.2 | 15.8 | -148.1 | 176.1 | 172.7 | 0 | 0 | 114.9 | ||||
| 808 | S | 29.8 | Very low | 33.8 | Very low | 86 Ų | 86 | 128.4 Ų | 128.4 | 60% | 0.601 | 76% | 0.764 | S | S | * | * | trans | -39.9 | 176.8 | 176.7 | 77.7 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 809 | Q | 28.9 | Very low | 33.8 | Very low | 183 Ų | 183 | 130 Ų | 130 | 86% | 0.855 | 77% | 0.768 | S | S | * | * | cis | -162.2 | 165.8 | 5.6 | -139.4 | 160.9 | 33.6 | 0 | 0 | 113 | ||||
| 810 | Y | 32.3 | Very low | 33.7 | Very low | 219 Ų | 219 | 133.1 Ų | 133.1 | 86% | 0.859 | 77% | 0.773 | S | S | * | * | trans | -93.7 | 177.4 | 162.4 | -88.1 | -81.8 | 0 | 0 | 0 | 110.7 | ||||
| 811 | P | 46.6 | Very low | 34.8 | Very low | 125 Ų | 125 | 130.9 Ų | 130.9 | 81% | 0.812 | 77% | 0.772 | S | S | * | * | cis | -127 | -165.9 | 8.1 | 44.4 | -27.8 | 0 | 0 | 0 | 113.8 | ||||
| 812 | G | 29.3 | Very low | 35.1 | Very low | 64 Ų | 64 | 131 Ų | 131 | 66% | 0.66 | 77% | 0.773 | S | S | * | * | cis | 132.9 | 141.4 | -12.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 813 | S | 29.5 | Very low | 34.9 | Very low | 137 Ų | 137 | 128.3 Ų | 128.3 | 96% | 0.958 | 77% | 0.765 | S | S | * | * | trans | 81.4 | 128.4 | 170.4 | -162.6 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 814 | G | 27 | Very low | 35.1 | Very low | 63 Ų | 63 | 126.9 Ų | 126.9 | 65% | 0.649 | 76% | 0.763 | S | S | * | * | trans | 132.1 | 122 | 139.5 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 815 | S | 28.1 | Very low | 36 | Very low | 127 Ų | 127 | 126.8 Ų | 126.8 | 89% | 0.888 | 76% | 0.762 | S | S | * | * | trans | 78.9 | 163.8 | 146.5 | 71.3 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 816 | T | 25.8 | Very low | 37.5 | Very low | 134 Ų | 134 | 124.7 Ų | 124.7 | 82% | 0.822 | 76% | 0.756 | S | S | * | * | trans | -134.7 | -154.5 | -169.2 | 47.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 817 | P | 63 | Low | 37.6 | Very low | 114 Ų | 114 | 125.3 Ų | 125.3 | 74% | 0.74 | 76% | 0.755 | S | S | * | * | -100.3 | -162.4 | -108.5 | 43.4 | -26.5 | 0 | 0 | 0 | 113.6 | |||||
| 818 | P | 51.6 | Low | 39.2 | Very low | 104 Ų | 104 | 121.6 Ų | 121.6 | 68% | 0.675 | 75% | 0.746 | S | S | * | * | -158.2 | -178.3 | 79 | 43.4 | -22.5 | 0 | 0 | 0 | 118.2 | |||||
| 819 | N | 28.4 | Very low | 39.4 | Very low | 146 Ų | 146 | 124.4 Ų | 124.4 | 78% | 0.781 | 76% | 0.755 | S | S | * | * | trans | 66.9 | 131.8 | 153.2 | -68.9 | -0.5 | 0 | 0 | 0 | 120.1 | ||||
| 820 | Q | 32.3 | Very low | 41 | Very low | 156 Ų | 156 | 120.7 Ų | 120.7 | 73% | 0.729 | 75% | 0.746 | S | S | * | * | cis | 66.4 | 174.6 | 4.4 | -109.6 | -146.4 | 6.2 | 0 | 0 | 117.3 | ||||
| 821 | P | 51 | Low | 41 | Very low | 115 Ų | 115 | 117.2 Ų | 117.2 | 75% | 0.747 | 74% | 0.743 | S | S | * | * | cis | -76.5 | -168.9 | -2 | 38.9 | -40.2 | 0 | 0 | 0 | 111.8 | ||||
| 822 | S | 34.4 | Very low | 40.6 | Very low | 98 Ų | 98 | 116.2 Ų | 116.2 | 69% | 0.685 | 74% | 0.738 | S | S | * | * | cis | -140.8 | -169.8 | 3.6 | 64.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 823 | G | 26.5 | Very low | 40.7 | Very low | 65 Ų | 65 | 119 Ų | 119 | 67% | 0.67 | 74% | 0.743 | S | S | * | * | cis | 165.6 | 166.7 | -3.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 824 | D | 35.8 | Very low | 41.1 | Very low | 155 Ų | 155 | 117.6 Ų | 117.6 | 83% | 0.829 | 74% | 0.739 | S | S | * | * | cis | -149.2 | -114 | -9.6 | -147.6 | -45.2 | 0 | 0 | 0 | 111.2 | ||||
| 825 | P | 67.1 | Low | 41.4 | Very low | 104 Ų | 104 | 118.4 Ų | 118.4 | 68% | 0.675 | 74% | 0.74 | S | S | * | * | trans | -103.1 | -164 | -178 | 48.2 | -40.9 | 0 | 0 | 0 | 111.8 | ||||
| 826 | P | 61 | Low | 41.8 | Very low | 104 Ų | 104 | 119.6 Ų | 119.6 | 68% | 0.675 | 73% | 0.732 | S | S | * | * | cis | -142.2 | 135.6 | 1.3 | 37.3 | -15.2 | 0 | 0 | 0 | 119.3 | ||||
| 827 | Q | 34.7 | Very low | 42.1 | Very low | 162 Ų | 162 | 120.9 Ų | 120.9 | 76% | 0.757 | 73% | 0.726 | S | S | * | * | 67 | 156.4 | 126.3 | -60.4 | -66.9 | -84.5 | 0 | 0 | 122.6 | |||||
| 828 | P | 60.6 | Low | 40.8 | Very low | 92 Ų | 92 | 121.8 Ų | 121.8 | 60% | 0.597 | 73% | 0.729 | S | S | * | * | cis | -146.1 | 153.8 | -32.9 | 38.3 | -20.1 | 0 | 0 | 0 | 118.4 | ||||
| 829 | N | 33.4 | Very low | 39.7 | Very low | 146 Ų | 146 | 120.4 Ų | 120.4 | 78% | 0.781 | 73% | 0.726 | S | S | * | * | trans | 54.7 | 169.1 | 139.5 | -63.9 | 0.1 | 0 | 0 | 0 | 123.4 | ||||
| 830 | P | 63.7 | Low | 40 | Very low | 105 Ų | 105 | 120.5 Ų | 120.5 | 68% | 0.682 | 73% | 0.732 | S | S | * | * | cis | -139.9 | -175.2 | -49.5 | 42.6 | -25.5 | 0 | 0 | 0 | 116.5 | ||||
| 831 | D | 31.1 | Very low | 39.8 | Very low | 146 Ų | 146 | 118.3 Ų | 118.3 | 78% | 0.781 | 73% | 0.734 | S | S | * | * | trans | 82.3 | 131.6 | 152.4 | -73 | -24 | 0 | 0 | 0 | 126 | ||||
| 832 | S | 37.8 | Very low | 40.4 | Very low | 103 Ų | 103 | 117.7 Ų | 117.7 | 72% | 0.72 | 73% | 0.73 | S | S | * | * | trans | 72.6 | 160.4 | 147.9 | -59.9 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 833 | T | 33.2 | Very low | 40.3 | Very low | 124 Ų | 124 | 122.3 Ų | 122.3 | 76% | 0.761 | 74% | 0.738 | S | S | * | * | cis | -166.5 | 139 | -43.1 | 41 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 834 | A | 36.1 | Very low | 40.9 | Very low | 106 Ų | 106 | 124.2 Ų | 124.2 | 88% | 0.876 | 74% | 0.741 | S | S | * | * | trans | 61.7 | 150.7 | 164.9 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 835 | A | 33.4 | Very low | 40.8 | Very low | 81 Ų | 81 | 121 Ų | 121 | 67% | 0.669 | 74% | 0.736 | S | S | * | * | cis | -168.2 | 179.8 | 4.3 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 836 | Q | 36.7 | Very low | 39.2 | Very low | 152 Ų | 152 | 123.1 Ų | 123.1 | 71% | 0.71 | 74% | 0.741 | S | S | * | * | cis | -171.8 | 167.6 | -13.2 | -98.4 | 173.3 | 88.9 | 0 | 0 | 104.5 | ||||
| 837 | K | 33.2 | Very low | 38.1 | Very low | 160 Ų | 160 | 127.7 Ų | 127.7 | 70% | 0.696 | 75% | 0.75 | S | S | * | * | cis | -159.4 | 142.9 | 1.1 | -112.7 | 168 | 172.5 | 146.4 | 0 | 106.2 | ||||
| 838 | V | 34.2 | Very low | 38.2 | Very low | 134 Ų | 134 | 125 Ų | 125 | 81% | 0.812 | 75% | 0.749 | S | S | * | * | 58.2 | 129.8 | 85.8 | 179.2 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 839 | A | 29.4 | Very low | 37.8 | Very low | 75 Ų | 75 | 126.3 Ų | 126.3 | 62% | 0.62 | 76% | 0.758 | S | S | * | * | cis | -175.7 | -171.4 | -15 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 840 | T | 34.7 | Very low | 37.8 | Very low | 147 Ų | 147 | 124.9 Ų | 124.9 | 90% | 0.902 | 76% | 0.759 | S | S | * | * | trans | 84.8 | 149.9 | 152.3 | 52.1 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 841 | S | 28.8 | Very low | 36.6 | Very low | 110 Ų | 110 | 123.6 Ų | 123.6 | 77% | 0.769 | 75% | 0.752 | S | S | * | * | trans | -126.2 | -150.5 | -170.9 | -170.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 842 | P | 63.8 | Low | 37 | Very low | 103 Ų | 103 | 125.6 Ų | 125.6 | 67% | 0.669 | 75% | 0.754 | S | S | * | * | -115.8 | 174.5 | -107 | 40.6 | -27 | 0 | 0 | 0 | 115.1 | |||||
| 843 | K | 31.5 | Very low | 36.9 | Very low | 194 Ų | 194 | 131.3 Ų | 131.3 | 84% | 0.843 | 76% | 0.76 | S | S | * | * | trans | 170 | 123.9 | 150 | -92.7 | 147.1 | -169.4 | 174.3 | 0 | 109 | ||||
| 844 | S | 38.6 | Very low | 37.2 | Very low | 106 Ų | 106 | 136 Ų | 136 | 74% | 0.741 | 76% | 0.764 | S | S | * | * | 85.7 | 131.2 | 57.2 | 79.9 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 845 | A | 34.4 | Very low | 37.2 | Very low | 86 Ų | 86 | 136.5 Ų | 136.5 | 71% | 0.711 | 76% | 0.756 | S | S | * | * | trans | 137.2 | 121 | 139.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 846 | L | 33.8 | Very low | 37.3 | Very low | 150 Ų | 150 | 138 Ų | 138 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | 66 | 106 | 127.2 | -60.7 | 173.9 | 0 | 0 | 0 | 123.9 | |||||
| 847 | K | 36.3 | Very low | 37.4 | Very low | 199 Ų | 199 | 139.4 Ų | 139.4 | 87% | 0.865 | 77% | 0.768 | S | S | * | * | 83.5 | 153.6 | 115.9 | -125.4 | 157.3 | -176.5 | 169.7 | 0 | 121.3 | |||||
| 848 | S | 37.2 | Very low | 37.3 | Very low | 107 Ų | 107 | 138.1 Ų | 138.1 | 75% | 0.748 | 77% | 0.769 | S | S | * | * | trans | -87.4 | -175.2 | -170.6 | -24.1 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 849 | P | 51.9 | Low | 37.2 | Very low | 118 Ų | 118 | 138.9 Ų | 138.9 | 77% | 0.766 | 77% | 0.768 | S | S | * | * | cis | -161.5 | 170.4 | 44.2 | 46.9 | -24.2 | 0 | 0 | 0 | 122.6 | ||||
| 850 | S | 33.7 | Very low | 37.5 | Very low | 116 Ų | 116 | 144.6 Ų | 144.6 | 81% | 0.811 | 78% | 0.779 | S | S | * | * | trans | 75.1 | 137.1 | 138.4 | -149.5 | 0 | 0 | 0 | 0 | 125.5 | ||||
| 851 | S | 39 | Very low | 37.4 | Very low | 78 Ų | 78 | 145.6 Ų | 145.6 | 55% | 0.545 | 78% | 0.778 | S | S | . | * | 126.2 | 111.9 | 117.9 | 179.4 | 0 | 0 | 0 | 0 | 122.1 | |||||
| 852 | K | 38.8 | Very low | 37.7 | Very low | 189 Ų | 189 | 151.5 Ų | 151.5 | 82% | 0.822 | 78% | 0.783 | S | S | * | * | trans | 72.5 | 158.4 | 144.5 | -68.1 | 168.3 | -159 | 156.6 | 0 | 119.9 | ||||
| 853 | R | 36.7 | Very low | 36 | Very low | 223 Ų | 223 | 153.4 Ų | 153.4 | 84% | 0.842 | 79% | 0.793 | S | S | * | * | cis | -179.5 | 160 | -19.5 | -174.7 | -169.9 | -130.1 | -155 | 3.2 | 111.4 | ||||
| 854 | R | 39.5 | Very low | 35.8 | Very low | 221 Ų | 221 | 149.4 Ų | 149.4 | 83% | 0.834 | 79% | 0.785 | S | S | * | * | trans | 94 | 161.7 | 162.3 | -72.3 | -168.1 | 125.4 | 153.5 | -2.4 | 119 | ||||
| 855 | T | 35 | Very low | 35.4 | Very low | 117 Ų | 117 | 154 Ų | 154 | 72% | 0.718 | 79% | 0.792 | S | S | * | * | 175.4 | 121.2 | -57.5 | 41.1 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 856 | S | 35.7 | Very low | 35.1 | Very low | 114 Ų | 114 | 159.4 Ų | 159.4 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | trans | 176.3 | 137.3 | 154.6 | 45.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 857 | Q | 38.7 | Very low | 34.8 | Very low | 180 Ų | 180 | 160.7 Ų | 160.7 | 84% | 0.841 | 80% | 0.804 | S | S | * | * | 69.1 | 136.1 | 58.7 | -77.2 | -166 | 0.7 | 0 | 0 | 114.8 | |||||
| 858 | N | 32.2 | Very low | 35 | Very low | 133 Ų | 133 | 155.7 Ų | 155.7 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | cis | -168.6 | -177.6 | -12.4 | -151 | -25.4 | 0 | 0 | 0 | 110.8 | ||||
| 859 | L | 32.4 | Very low | 34.3 | Very low | 151 Ų | 151 | 156.8 Ų | 156.8 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | trans | 75.2 | 138.9 | 173.2 | -53.2 | 167.3 | 0 | 0 | 0 | 116.5 | ||||
| 860 | K | 35.6 | Very low | 32.9 | Very low | 194 Ų | 194 | 156.2 Ų | 156.2 | 84% | 0.843 | 79% | 0.788 | S | S | * | * | cis | 98.7 | 106.5 | 5.8 | -165.7 | -171.3 | -179.2 | -175.1 | 0 | 117.4 | ||||
| 861 | L | 32.7 | Very low | 32.4 | Very low | 168 Ų | 168 | 158.7 Ų | 158.7 | 88% | 0.88 | 79% | 0.787 | S | S | * | * | trans | -160.9 | 170.1 | 149.6 | -112.2 | 174.2 | 0 | 0 | 0 | 112 | ||||
| 862 | R | 33.4 | Very low | 31.7 | Very low | 234 Ų | 234 | 161.1 Ų | 161.1 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | trans | -138.5 | 145 | 171.8 | -69.2 | 178.2 | 179.2 | 152.8 | -6.1 | 109 | ||||
| 863 | V | 28.7 | Very low | 30.9 | Very low | 144 Ų | 144 | 159.6 Ų | 159.6 | 87% | 0.873 | 79% | 0.787 | S | S | * | * | trans | -139.4 | 165.6 | 157.2 | -175.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 864 | T | 28.3 | Very low | 30.3 | Very low | 110 Ų | 110 | 157.4 Ų | 157.4 | 68% | 0.675 | 79% | 0.787 | S | S | * | * | trans | -118.8 | 149.8 | -157.3 | 42.2 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 865 | F | 29.7 | Very low | 29.9 | Very low | 202 Ų | 202 | 151.7 Ų | 151.7 | 89% | 0.886 | 78% | 0.778 | S | S | * | * | trans | 37.4 | 121 | 150 | -65.1 | -66.8 | 0 | 0 | 0 | 120.9 | ||||
| 866 | E | 27.7 | Very low | 29.4 | Very low | 199 Ų | 199 | 150.9 Ų | 150.9 | 93% | 0.93 | 78% | 0.777 | S | S | * | * | trans | -145.5 | 155.7 | 133.5 | -153.2 | 157 | -164 | 0 | 0 | 109.3 | ||||
| 867 | E | 26.7 | Very low | 28.9 | Very low | 177 Ų | 177 | 152.5 Ų | 152.5 | 83% | 0.827 | 78% | 0.776 | S | S | * | * | trans | -122 | 176.7 | 178.7 | -120.9 | -162.9 | 118.8 | 0 | 0 | 107.5 | ||||
| 868 | P | 41 | Very low | 28.1 | Very low | 94 Ų | 94 | 151.7 Ų | 151.7 | 61% | 0.61 | 77% | 0.772 | S | S | * | * | cis | -133.1 | -153.2 | -5 | 30.9 | -6.2 | 0 | 0 | 0 | 111.9 | ||||
| 869 | V | 22.4 | Very low | 27.8 | Very low | 130 Ų | 130 | 151.8 Ų | 151.8 | 79% | 0.788 | 77% | 0.772 | S | S | * | * | trans | 72.4 | 141.1 | 156.2 | 165.6 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 870 | V | 23 | Very low | 27.3 | Very low | 107 Ų | 107 | 152 Ų | 152 | 65% | 0.648 | 77% | 0.774 | S | S | * | * | cis | -165.6 | 154 | -35.4 | 96.3 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 871 | Q | 23.5 | Very low | 26.9 | Very low | 168 Ų | 168 | 146.7 Ų | 146.7 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | trans | 62.6 | 165.3 | 169.5 | -80.7 | 173.1 | -70.9 | 0 | 0 | 116 | ||||
| 872 | M | 23.6 | Very low | 26.5 | Very low | 129 Ų | 129 | 146 Ų | 146 | 64% | 0.635 | 77% | 0.767 | S | S | * | * | cis | -163.2 | 146.1 | -19.1 | 165.1 | 161.3 | 164.7 | 0 | 0 | 109.2 | ||||
| 873 | E | 22.8 | Very low | 26.3 | Very low | 156 Ų | 156 | 142 Ų | 142 | 73% | 0.729 | 76% | 0.755 | S | S | * | * | trans | 61.5 | 135.9 | 172.8 | -71.5 | 171 | 137.2 | 0 | 0 | 116.3 | ||||
| 874 | Q | 24.7 | Very low | 26.2 | Very low | 178 Ų | 178 | 140 Ų | 140 | 83% | 0.832 | 74% | 0.74 | S | S | * | * | 61.9 | 147.8 | 62.7 | -73.2 | -151 | 43.5 | 0 | 0 | 114.4 | |||||
| 875 | P | 30 | Very low | 26.4 | Very low | 101 Ų | 101 | 142.5 Ų | 142.5 | 66% | 0.656 | 74% | 0.742 | S | S | * | * | cis | -131.5 | -165.7 | 1 | 38 | -18.8 | 0 | 0 | 0 | 114.5 | ||||
| 876 | S | 23.7 | Very low | 26.3 | Very low | 99 Ų | 99 | 137.9 Ų | 137.9 | 69% | 0.692 | 73% | 0.726 | S | S | * | * | trans | 81.8 | 127.5 | 164.4 | -44.4 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 877 | L | 25.2 | Very low | 26.4 | Very low | 148 Ų | 148 | 136.9 Ų | 136.9 | 78% | 0.775 | 72% | 0.719 | S | S | * | * | 67.3 | 123.4 | 54.2 | -62.4 | 173.7 | 0 | 0 | 0 | 112.2 | |||||
| 878 | E | 22.9 | Very low | 26.5 | Very low | 163 Ų | 163 | 131.9 Ų | 131.9 | 76% | 0.762 | 72% | 0.715 | S | S | * | * | cis | -165.6 | -167.9 | -0.1 | -150.8 | 177 | -146.8 | 0 | 0 | 111.2 | ||||
| 879 | L | 26.4 | Very low | 26.1 | Very low | 136 Ų | 136 | 138.8 Ų | 138.8 | 71% | 0.712 | 73% | 0.729 | S | S | * | * | trans | 82.7 | 93.8 | 161.4 | -67.1 | 167.6 | 0 | 0 | 0 | 120.1 | ||||
| 880 | N | 22.4 | Very low | 26.3 | Very low | 154 Ų | 154 | 138.3 Ų | 138.3 | 82% | 0.824 | 73% | 0.726 | S | S | * | * | 48 | 111.4 | 117.2 | -63.5 | -10.2 | 0 | 0 | 0 | 120.4 | |||||
| 881 | G | 26.7 | Very low | 26.4 | Very low | 83 Ų | 83 | 139.7 Ų | 139.7 | 86% | 0.856 | 73% | 0.73 | S | S | * | * | trans | -127.2 | 106.1 | 156.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 882 | E | 24.7 | Very low | 26.4 | Very low | 155 Ų | 155 | 138.3 Ų | 138.3 | 72% | 0.724 | 72% | 0.723 | S | S | * | * | trans | -81.1 | 170.6 | -164.7 | -142.1 | -150.5 | 134.7 | 0 | 0 | 115.3 | ||||
| 883 | K | 28.4 | Very low | 26.4 | Very low | 148 Ų | 148 | 141.7 Ų | 141.7 | 64% | 0.643 | 73% | 0.729 | S | S | * | * | trans | 73.7 | 113.7 | 162.9 | -72.1 | 167.3 | 169.8 | 63.1 | 0 | 117.3 | ||||
| 884 | D | 26.8 | Very low | 26.3 | Very low | 104 Ų | 104 | 140 Ų | 140 | 56% | 0.556 | 73% | 0.729 | S | S | * | * | 81.6 | 104.3 | 64.4 | 171.5 | 47 | 0 | 0 | 0 | 114 | |||||
| 885 | K | 31.8 | Very low | 26.2 | Very low | 162 Ų | 162 | 136.1 Ų | 136.1 | 70% | 0.704 | 72% | 0.721 | S | S | * | * | -174.6 | 114.4 | 123.4 | -101 | 154.7 | -170.1 | 81.3 | 0 | 117.4 | |||||
| 886 | D | 28 | Very low | 25.8 | Very low | 104 Ų | 104 | 137.7 Ų | 137.7 | 56% | 0.556 | 73% | 0.73 | S | S | * | * | 66.9 | 127.6 | 117.1 | -93.3 | -17.8 | 0 | 0 | 0 | 125.7 | |||||
| 887 | K | 30.5 | Very low | 25.8 | Very low | 178 Ų | 178 | 138.5 Ų | 138.5 | 77% | 0.774 | 74% | 0.735 | S | S | * | * | trans | 67.6 | 107.4 | 130.6 | -68.1 | 167.9 | 176.9 | 85.2 | 0 | 120.4 | ||||
| 888 | G | 28.9 | Very low | 25.7 | Very low | 73 Ų | 73 | 138.9 Ų | 138.9 | 75% | 0.753 | 74% | 0.738 | S | S | * | * | trans | -119.3 | -12.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 889 | R | 31.2 | Very low | 25.7 | Very low | 238 Ų | 238 | 140.7 Ų | 140.7 | 90% | 0.898 | 75% | 0.746 | S | S | * | * | trans | 70.1 | 151.2 | -174.5 | -50.5 | 179.3 | 176.1 | -159.8 | -4.5 | 113.5 | ||||
| 890 | T | 27.4 | Very low | 25.7 | Very low | 120 Ų | 120 | 139.9 Ų | 139.9 | 74% | 0.736 | 75% | 0.752 | S | S | * | * | -162.5 | 126 | 53.4 | -58.7 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 891 | L | 25.7 | Very low | 25.9 | Very low | 137 Ų | 137 | 136.5 Ų | 136.5 | 72% | 0.717 | 75% | 0.753 | S | S | * | * | 39.3 | 136 | 105.9 | -67.2 | 164.2 | 0 | 0 | 0 | 115.7 | |||||
| 892 | Q | 22.9 | Very low | 25.9 | Very low | 139 Ų | 139 | 139.6 Ų | 139.6 | 65% | 0.65 | 75% | 0.75 | S | S | * | * | cis | -169.8 | 159.6 | -10.3 | -146.7 | -171.7 | 39.6 | 0 | 0 | 110.7 | ||||
| 893 | R | 23.4 | Very low | 26 | Very low | 200 Ų | 200 | 139.1 Ų | 139.1 | 76% | 0.755 | 75% | 0.748 | S | S | * | * | trans | 70 | 115.3 | 146.3 | -91.1 | 179.4 | -170.6 | -168.4 | 1.1 | 123.5 | ||||
| 894 | T | 21.1 | Very low | 25.9 | Very low | 121 Ų | 121 | 138.7 Ų | 138.7 | 74% | 0.742 | 75% | 0.752 | S | S | * | * | 78.8 | 141 | 123.6 | 53.2 | 0 | 0 | 0 | 0 | 125.7 | |||||
| 895 | S | 21.4 | Very low | 26 | Very low | 95 Ų | 95 | 142.6 Ų | 142.6 | 66% | 0.664 | 76% | 0.764 | S | S | * | * | trans | 80 | 98.1 | 133.7 | 60 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 896 | T | 21.6 | Very low | 26.1 | Very low | 135 Ų | 135 | 146.4 Ų | 146.4 | 83% | 0.828 | 77% | 0.774 | S | S | * | * | 39.3 | 116.2 | 117.2 | 59.6 | 0 | 0 | 0 | 0 | 121.9 | |||||
| 897 | S | 23.9 | Very low | 26.9 | Very low | 115 Ų | 115 | 146.6 Ų | 146.6 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | -168.1 | 140.3 | 128.5 | 49.1 | 0 | 0 | 0 | 0 | 107.6 | |||||
| 898 | N | 23.1 | Very low | 26.6 | Very low | 156 Ų | 156 | 148.4 Ų | 148.4 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | 55.2 | 98 | 56.1 | -87.1 | 21.1 | 0 | 0 | 0 | 114.5 | |||||
| 899 | E | 24.3 | Very low | 26.7 | Very low | 201 Ų | 201 | 147.9 Ų | 147.9 | 94% | 0.939 | 78% | 0.784 | S | S | * | * | -162.2 | 155.4 | 115.3 | -113.9 | -177 | 158.3 | 0 | 0 | 112.6 | |||||
| 900 | S | 25.6 | Very low | 26.6 | Very low | 120 Ų | 120 | 141.2 Ų | 141.2 | 84% | 0.839 | 78% | 0.78 | S | S | * | * | trans | -110.2 | 137 | 172 | 44.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 901 | G | 26.2 | Very low | 26.7 | Very low | 82 Ų | 82 | 144.9 Ų | 144.9 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | -159.1 | 97.5 | -170.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 902 | D | 26.7 | Very low | 26.9 | Very low | 148 Ų | 148 | 148.9 Ų | 148.9 | 79% | 0.791 | 79% | 0.791 | S | S | * | * | trans | -76.1 | 168.7 | -179.6 | -174.2 | 19.1 | 0 | 0 | 0 | 113.3 | ||||
| 903 | Q | 26.5 | Very low | 27.3 | Very low | 146 Ų | 146 | 147 Ų | 147 | 68% | 0.682 | 79% | 0.794 | S | S | * | * | trans | 101 | 104.5 | 156.2 | -57 | -168 | 28.2 | 0 | 0 | 122.5 | ||||
| 904 | L | 27.3 | Very low | 28 | Very low | 139 Ų | 139 | 143.5 Ų | 143.5 | 73% | 0.728 | 79% | 0.789 | S | S | * | * | 70.9 | 153.4 | 116.4 | -71.2 | 168.5 | 0 | 0 | 0 | 123.8 | |||||
| 905 | K | 27.8 | Very low | 28.3 | Very low | 186 Ų | 186 | 145.1 Ų | 145.1 | 81% | 0.809 | 79% | 0.79 | S | S | * | * | trans | 78 | 107.3 | 159.5 | -72.4 | 161 | -176.7 | 169.7 | 0 | 119.6 | ||||
| 906 | R | 35 | Very low | 28.9 | Very low | 242 Ų | 242 | 148.4 Ų | 148.4 | 91% | 0.913 | 80% | 0.795 | S | S | * | * | trans | -69 | 158 | 140.2 | -60.2 | -176.2 | -174.9 | 101.6 | 0.8 | 110.1 | ||||
| 907 | P | 43.7 | Very low | 29.3 | Very low | 107 Ų | 107 | 147.5 Ų | 147.5 | 70% | 0.695 | 79% | 0.789 | S | S | * | * | -136 | 148 | 124.1 | 13.7 | 7.7 | 0 | 0 | 0 | 114 | |||||
| 908 | F | 25.3 | Very low | 29.7 | Very low | 216 Ų | 216 | 149.5 Ų | 149.5 | 95% | 0.947 | 79% | 0.79 | S | S | * | * | trans | 39.2 | 151.8 | 149.2 | -66.5 | -100.6 | 0 | 0 | 0 | 121.9 | ||||
| 909 | G | 30.2 | Very low | 29.9 | Very low | 63 Ų | 63 | 147.6 Ų | 147.6 | 65% | 0.649 | 79% | 0.789 | S | S | * | * | cis | 162.6 | 170.6 | -3.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 910 | A | 30.6 | Very low | 30.1 | Very low | 98 Ų | 98 | 140.9 Ų | 140.9 | 81% | 0.81 | 77% | 0.774 | S | S | * | * | trans | 68.6 | 164.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 911 | F | 27.9 | Very low | 30.2 | Very low | 197 Ų | 197 | 142.8 Ų | 142.8 | 86% | 0.864 | 78% | 0.775 | S | S | * | * | 167.4 | 121.6 | -51.1 | -117.2 | -70.6 | 0 | 0 | 0 | 109.5 | |||||
| 912 | R | 30.5 | Very low | 30.5 | Very low | 220 Ų | 220 | 147.1 Ų | 147.1 | 83% | 0.83 | 77% | 0.773 | S | S | * | * | trans | 179.2 | 124.2 | 151.8 | -102.1 | 171.2 | -174.4 | -82.7 | 0.7 | 106.4 | ||||
| 913 | S | 31.5 | Very low | 30.5 | Very low | 101 Ų | 101 | 145.7 Ų | 145.7 | 71% | 0.706 | 77% | 0.765 | S | S | * | * | cis | 83.4 | 153.5 | 26.9 | -158.7 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 914 | I | 38.9 | Very low | 30.6 | Very low | 126 Ų | 126 | 145.4 Ų | 145.4 | 65% | 0.646 | 77% | 0.768 | S | S | * | * | trans | 90.8 | 125.1 | -158.5 | -60.4 | 163.5 | 0 | 0 | 0 | 110.8 | ||||
| 915 | M | 26.2 | Very low | 30.7 | Very low | 154 Ų | 154 | 145 Ų | 145 | 76% | 0.759 | 77% | 0.767 | S | S | * | * | cis | -154.8 | 158.8 | -10.8 | -96.8 | -171.9 | -50.7 | 0 | 0 | 107.1 | ||||
| 916 | E | 35 | Very low | 31 | Very low | 164 Ų | 164 | 142 Ų | 142 | 77% | 0.766 | 76% | 0.76 | S | S | * | * | cis | 87.9 | 125.7 | 22.2 | -162.9 | 169.4 | -156.7 | 0 | 0 | 113.3 | ||||
| 917 | T | 29.6 | Very low | 30.8 | Very low | 117 Ų | 117 | 135.4 Ų | 135.4 | 72% | 0.718 | 74% | 0.743 | S | S | * | * | cis | -165.9 | -175.5 | -5.3 | -108.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 918 | L | 32.3 | Very low | 30.2 | Very low | 156 Ų | 156 | 141.4 Ų | 141.4 | 82% | 0.817 | 75% | 0.753 | S | S | * | * | trans | 100.1 | 134.7 | 172.9 | -53 | 172.8 | 0 | 0 | 0 | 115.3 | ||||
| 919 | S | 26.8 | Very low | 30.6 | Very low | 116 Ų | 116 | 138.6 Ų | 138.6 | 81% | 0.811 | 74% | 0.743 | S | S | * | * | cis | 83.7 | 131 | 25.2 | -163.6 | 0 | 0 | 0 | 0 | 115 | ||||
| 920 | G | 28.8 | Very low | 30.7 | Very low | 61 Ų | 61 | 140 Ų | 140 | 63% | 0.629 | 75% | 0.749 | S | S | * | * | cis | 171.3 | -168.3 | 0.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 921 | N | 27.4 | Very low | 30.8 | Very low | 159 Ų | 159 | 139 Ų | 139 | 85% | 0.85 | 74% | 0.741 | S | S | * | * | trans | 64.3 | 122.4 | 173.7 | -61.4 | -22 | 0 | 0 | 0 | 117.6 | ||||
| 922 | Q | 32.4 | Very low | 30.8 | Very low | 173 Ų | 173 | 136.2 Ų | 136.2 | 81% | 0.808 | 74% | 0.735 | S | S | * | * | 175.2 | 167.7 | 86.9 | -93 | -155.2 | 83.4 | 0 | 0 | 110.1 | |||||
| 923 | N | 26.5 | Very low | 30.9 | Very low | 118 Ų | 118 | 132.4 Ų | 132.4 | 63% | 0.631 | 73% | 0.726 | S | S | * | * | cis | -171.4 | -164.8 | -16.8 | -169 | -6.4 | 0 | 0 | 0 | 108.1 | ||||
| 924 | N | 29.5 | Very low | 30.8 | Very low | 140 Ų | 140 | 133.7 Ų | 133.7 | 75% | 0.749 | 72% | 0.724 | S | S | * | * | trans | -55.8 | 170.6 | 178.1 | -57.2 | -36.3 | 0 | 0 | 0 | 114.8 | ||||
| 925 | N | 29.3 | Very low | 30.4 | Very low | 130 Ų | 130 | 136 Ų | 136 | 70% | 0.695 | 73% | 0.729 | S | S | * | * | cis | -172.9 | 166.5 | 35.5 | -159.7 | 6.3 | 0 | 0 | 0 | 114.4 | ||||
| 926 | N | 33.2 | Very low | 30.7 | Very low | 124 Ų | 124 | 135.2 Ų | 135.2 | 66% | 0.663 | 73% | 0.734 | S | S | * | * | trans | 59.9 | 137.4 | 160.3 | -77.5 | -29.9 | 0 | 0 | 0 | 119.3 | ||||
| 927 | N | 31.6 | Very low | 30.5 | Very low | 104 Ų | 104 | 132 Ų | 132 | 56% | 0.556 | 73% | 0.729 | S | S | * | * | cis | 108.7 | 122.2 | 22.9 | 175.4 | 27.8 | 0 | 0 | 0 | 112 | ||||
| 928 | Y | 31 | Very low | 30.5 | Very low | 233 Ų | 233 | 132 Ų | 132 | 91% | 0.914 | 73% | 0.729 | S | S | * | * | trans | -131.1 | 127.8 | 153.1 | -126.2 | -87.1 | 0 | 0 | 0 | 110.6 | ||||
| 929 | Q | 33.1 | Very low | 30.5 | Very low | 157 Ų | 157 | 132.1 Ų | 132.1 | 73% | 0.734 | 73% | 0.73 | S | S | * | * | trans | -82.2 | 164.2 | 178.5 | -78.4 | 175.5 | -24.3 | 0 | 0 | 111 | ||||
| 930 | A | 32.4 | Very low | 31.9 | Very low | 93 Ų | 93 | 131.3 Ų | 131.3 | 77% | 0.769 | 72% | 0.722 | S | S | * | * | cis | -168.6 | -159.4 | -18 | 0 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 931 | A | 32.2 | Very low | 32.1 | Very low | 77 Ų | 77 | 135.4 Ų | 135.4 | 64% | 0.636 | 73% | 0.729 | S | S | * | * | cis | -159.7 | -171.3 | 8.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 932 | N | 28.5 | Very low | 32.4 | Very low | 138 Ų | 138 | 133.5 Ų | 133.5 | 74% | 0.738 | 72% | 0.723 | S | S | * | * | trans | 77.2 | 147.3 | 180 | -56.1 | -66.2 | 0 | 0 | 0 | 114.4 | ||||
| 933 | Q | 31.8 | Very low | 32.6 | Very low | 140 Ų | 140 | 129.6 Ų | 129.6 | 65% | 0.654 | 72% | 0.715 | S | S | * | * | cis | -151.6 | 175.2 | -11.8 | -125 | -22.4 | -60.6 | 0 | 0 | 111.1 | ||||
| 934 | L | 29.8 | Very low | 32.8 | Very low | 128 Ų | 128 | 131.9 Ų | 131.9 | 67% | 0.67 | 73% | 0.726 | S | S | * | * | trans | 50.4 | 68.9 | 149.5 | -67.2 | 170.6 | 0 | 0 | 0 | 118.7 | ||||
| 935 | K | 30.5 | Very low | 32.9 | Very low | 173 Ų | 173 | 128.3 Ų | 128.3 | 75% | 0.752 | 72% | 0.722 | S | S | * | * | 63.8 | 118.4 | 119.9 | -66.2 | 176.4 | 179.6 | 179.7 | 0 | 121.7 | |||||
| 936 | T | 32.1 | Very low | 33.4 | Very low | 138 Ų | 138 | 133.8 Ų | 133.8 | 85% | 0.847 | 73% | 0.733 | S | S | * | * | trans | 68.1 | 142.1 | 132.7 | 56.7 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 937 | S | 31.1 | Very low | 33.5 | Very low | 96 Ų | 96 | 136.5 Ų | 136.5 | 67% | 0.671 | 74% | 0.739 | S | S | * | * | cis | -169.9 | 159.4 | -5.2 | 175.3 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 938 | T | 29.8 | Very low | 33.6 | Very low | 117 Ų | 117 | 137 Ų | 137 | 72% | 0.718 | 75% | 0.746 | S | S | * | * | trans | 63.8 | 114 | 154.7 | 28.4 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 939 | L | 32.6 | Very low | 33.7 | Very low | 159 Ų | 159 | 131.2 Ų | 131.2 | 83% | 0.832 | 74% | 0.735 | S | S | * | * | 64.2 | 156.1 | 64.4 | -67.5 | -177.2 | 0 | 0 | 0 | 116.1 | |||||
| 940 | P | 56.1 | Low | 33.7 | Very low | 99 Ų | 99 | 131 Ų | 131 | 64% | 0.643 | 74% | 0.739 | S | S | * | * | cis | -154.4 | -168.6 | -32.4 | 42.9 | -22.5 | 0 | 0 | 0 | 118.5 | ||||
| 941 | L | 34 | Very low | 33.8 | Very low | 147 Ų | 147 | 130.5 Ų | 130.5 | 77% | 0.77 | 74% | 0.735 | S | S | * | * | trans | 99.7 | 135.8 | 142.4 | -75.7 | 168.5 | 0 | 0 | 0 | 126.8 | ||||
| 942 | T | 33.2 | Very low | 33.8 | Very low | 120 Ų | 120 | 137.3 Ų | 137.3 | 74% | 0.736 | 75% | 0.75 | S | S | * | * | trans | 70.6 | 160.9 | 143 | 49.6 | 0 | 0 | 0 | 0 | 124 | ||||
| 943 | S | 36.4 | Very low | 33.7 | Very low | 91 Ų | 91 | 134.3 Ų | 134.3 | 64% | 0.636 | 75% | 0.752 | S | S | * | * | cis | 179.9 | 164.7 | -35.6 | 64.1 | 0 | 0 | 0 | 0 | 114 | ||||
| 944 | L | 30.9 | Very low | 33.6 | Very low | 166 Ų | 166 | 135.2 Ų | 135.2 | 87% | 0.869 | 76% | 0.761 | S | S | * | * | trans | 66.8 | 163.2 | 167.8 | -84.6 | 68.6 | 0 | 0 | 0 | 118.3 | ||||
| 945 | G | 32 | Very low | 35.1 | Very low | 64 Ų | 64 | 134.4 Ų | 134.4 | 66% | 0.66 | 76% | 0.764 | S | S | * | * | cis | 151.9 | 142.7 | -17 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 946 | R | 39.7 | Very low | 35 | Very low | 245 Ų | 245 | 130.7 Ų | 130.7 | 93% | 0.925 | 77% | 0.765 | S | S | * | * | trans | 79 | 167.2 | 166.7 | -56.4 | 177.7 | 178.3 | -167.9 | 0.6 | 118.9 | ||||
| 947 | K | 35.8 | Very low | 34.9 | Very low | 181 Ų | 181 | 129 Ų | 129 | 79% | 0.787 | 76% | 0.759 | S | S | * | * | cis | -177.6 | 171 | -39.7 | -160.3 | 178.1 | -177 | -176 | 0 | 110.1 | ||||
| 948 | T | 32.7 | Very low | 34.8 | Very low | 116 Ų | 116 | 128.7 Ų | 128.7 | 71% | 0.712 | 76% | 0.757 | S | S | * | * | trans | 74.9 | 153.8 | 159.5 | 63.1 | 0 | 0 | 0 | 0 | 120 | ||||
| 949 | T | 32.5 | Very low | 34.7 | Very low | 111 Ų | 111 | 129.2 Ų | 129.2 | 68% | 0.681 | 76% | 0.76 | S | S | * | * | cis | -170.2 | 152.7 | -19.2 | 29.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 950 | D | 33.1 | Very low | 34.6 | Very low | 152 Ų | 152 | 127.4 Ų | 127.4 | 81% | 0.813 | 75% | 0.751 | S | S | * | * | trans | 37.1 | 156.9 | 139.6 | -63.1 | -66 | 0 | 0 | 0 | 124.5 | ||||
| 951 | A | 36.2 | Very low | 33.3 | Very low | 83 Ų | 83 | 131.9 Ų | 131.9 | 69% | 0.686 | 76% | 0.761 | S | S | * | * | cis | -176.7 | 179.8 | -17 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 952 | K | 30.3 | Very low | 33.1 | Very low | 219 Ų | 219 | 128.3 Ų | 128.3 | 95% | 0.952 | 76% | 0.759 | S | S | * | * | trans | 77 | 134.9 | 160.2 | -69.5 | 179.4 | 174.8 | 175.1 | 0 | 121.6 | ||||
| 953 | G | 28 | Very low | 32.9 | Very low | 75 Ų | 75 | 131.9 Ų | 131.9 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | trans | 168.2 | 127.8 | 160.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 954 | N | 29.3 | Very low | 32.6 | Very low | 160 Ų | 160 | 134.2 Ų | 134.2 | 86% | 0.856 | 77% | 0.77 | S | S | * | * | trans | -174 | 166.9 | -175 | -135.4 | 15.5 | 0 | 0 | 0 | 110 | ||||
| 955 | P | 60.3 | Low | 32.4 | Very low | 111 Ų | 111 | 136.2 Ų | 136.2 | 72% | 0.721 | 77% | 0.772 | S | S | * | * | cis | -130.6 | -150.6 | -38.1 | 38.3 | -18.5 | 0 | 0 | 0 | 112.2 | ||||
| 956 | A | 29.1 | Very low | 32.1 | Very low | 94 Ų | 94 | 138.1 Ų | 138.1 | 78% | 0.777 | 78% | 0.781 | S | S | * | * | trans | 82 | 148.4 | 162 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 957 | S | 30.3 | Very low | 31.6 | Very low | 104 Ų | 104 | 135.4 Ų | 135.4 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | cis | -165.2 | 161.6 | -11.8 | 52.4 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 958 | S | 29.3 | Very low | 31.1 | Very low | 88 Ų | 88 | 135.7 Ų | 135.7 | 62% | 0.615 | 79% | 0.785 | S | S | * | * | trans | 69.8 | 109.7 | 135.7 | 61.9 | 0 | 0 | 0 | 0 | 125.9 | ||||
| 959 | T | 27.9 | Very low | 30.7 | Very low | 128 Ų | 128 | 140.7 Ų | 140.7 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | trans | 69.1 | 166.4 | 133.9 | 73.3 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 960 | N | 30 | Very low | 30.4 | Very low | 121 Ų | 121 | 140.1 Ų | 140.1 | 65% | 0.647 | 79% | 0.793 | S | S | * | * | cis | -164.3 | 154.2 | 10.1 | -141.1 | -27.7 | 0 | 0 | 0 | 113.8 | ||||
| 961 | K | 28.8 | Very low | 30 | Very low | 194 Ų | 194 | 137.8 Ų | 137.8 | 84% | 0.843 | 79% | 0.788 | S | S | * | * | trans | 61 | 154 | 161.3 | -61.4 | 159.3 | -177 | 172.6 | 0 | 118.9 | ||||
| 962 | G | 28.8 | Very low | 29.5 | Very low | 72 Ų | 72 | 138.8 Ų | 138.8 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | cis | 156.7 | 157.6 | -14.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 963 | K | 30.3 | Very low | 29.5 | Very low | 195 Ų | 195 | 135.6 Ų | 135.6 | 85% | 0.848 | 78% | 0.781 | S | S | * | * | trans | 89.7 | 120 | 162.3 | -65 | -174.1 | 176.1 | -177.7 | 0 | 123 | ||||
| 964 | N | 28.8 | Very low | 29.4 | Very low | 140 Ų | 140 | 139 Ų | 139 | 75% | 0.749 | 78% | 0.782 | S | S | * | * | 85.6 | 115.7 | 128.4 | -65.4 | 5.9 | 0 | 0 | 0 | 124.6 | |||||
| 965 | K | 27.9 | Very low | 29.4 | Very low | 208 Ų | 208 | 139.3 Ų | 139.3 | 90% | 0.904 | 78% | 0.782 | S | S | * | * | trans | 41.1 | 120 | 136.1 | -70.3 | -167.6 | 172.7 | -166.9 | 0 | 121.6 | ||||
| 966 | A | 26.3 | Very low | 27.9 | Very low | 103 Ų | 103 | 139.5 Ų | 139.5 | 85% | 0.851 | 79% | 0.786 | S | S | * | * | -165.4 | 153.4 | 110.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 967 | E | 27.6 | Very low | 28.1 | Very low | 189 Ų | 189 | 140.4 Ų | 140.4 | 88% | 0.883 | 79% | 0.787 | S | S | * | * | trans | -108.2 | 144.3 | 171.5 | -66 | 168.9 | 124.5 | 0 | 0 | 109.8 | ||||
| 968 | M | 25.3 | Very low | 28.1 | Very low | 186 Ų | 186 | 142.1 Ų | 142.1 | 92% | 0.916 | 79% | 0.788 | S | S | * | * | trans | -157.4 | 162.7 | 156.7 | -111.3 | -56.8 | 130.3 | 0 | 0 | 111.3 | ||||
| 969 | Y | 25.1 | Very low | 28.1 | Very low | 222 Ų | 222 | 144.4 Ų | 144.4 | 87% | 0.871 | 80% | 0.798 | S | S | * | * | trans | -97.9 | 163.1 | -162.3 | -117.2 | -106.1 | 0 | 0 | 0 | 115 | ||||
| 970 | S | 25.8 | Very low | 28.7 | Very low | 98 Ų | 98 | 145.5 Ų | 145.5 | 69% | 0.685 | 80% | 0.799 | S | S | * | * | trans | 88.9 | 143.7 | 148.2 | -154.4 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 971 | S | 24.5 | Very low | 29.1 | Very low | 103 Ų | 103 | 145.8 Ų | 145.8 | 72% | 0.72 | 80% | 0.799 | S | S | * | * | trans | 78.3 | 144.6 | 153.3 | -56.7 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 972 | C | 26.9 | Very low | 29.2 | Very low | 105 Ų | 105 | 143 Ų | 143 | 71% | 0.709 | 79% | 0.789 | S | S | * | * | cis | 178 | 155.4 | -34.8 | -116.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 973 | I | 29.4 | Very low | 29.5 | Very low | 151 Ų | 151 | 146.2 Ų | 146.2 | 77% | 0.774 | 79% | 0.785 | S | S | * | * | trans | 69.1 | 146.9 | 156.7 | -65.7 | 161.8 | 0 | 0 | 0 | 112.8 | ||||
| 974 | N | 26.2 | Very low | 30 | Very low | 148 Ų | 148 | 144.3 Ų | 144.3 | 79% | 0.791 | 78% | 0.778 | S | S | * | * | cis | -139.7 | 160.2 | 16.6 | -142.2 | -15.9 | 0 | 0 | 0 | 112.3 | ||||
| 975 | L | 29.3 | Very low | 30.3 | Very low | 165 Ų | 165 | 144 Ų | 144 | 86% | 0.864 | 78% | 0.776 | S | S | * | * | trans | -135.1 | 137.8 | 165.3 | -111.9 | 168.6 | 0 | 0 | 0 | 108.2 | ||||
| 976 | S | 28.9 | Very low | 30.5 | Very low | 115 Ų | 115 | 140.8 Ų | 140.8 | 80% | 0.804 | 76% | 0.758 | S | S | * | * | trans | -117.8 | 115.7 | -172.3 | -173.4 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 977 | S | 32 | Very low | 31.1 | Very low | 113 Ų | 113 | 140.7 Ų | 140.7 | 79% | 0.79 | 74% | 0.743 | S | S | * | * | trans | -149.6 | 106.1 | 172.8 | -64.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 978 | N | 30.6 | Very low | 31.6 | Very low | 140 Ų | 140 | 140.1 Ų | 140.1 | 75% | 0.749 | 73% | 0.734 | S | S | * | * | trans | -162.8 | 80.3 | 174.8 | -130.8 | -15.5 | 0 | 0 | 0 | 114.5 | ||||
| 979 | T | 30.5 | Very low | 32 | Very low | 137 Ų | 137 | 134 Ų | 134 | 84% | 0.84 | 71% | 0.714 | S | S | * | * | trans | -154.1 | 77.9 | 167 | 49.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 980 | L | 39.9 | Very low | 32.5 | Very low | 150 Ų | 150 | 132.2 Ų | 132.2 | 79% | 0.785 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -155.1 | -0.7 | 171 | -115.5 | 171.3 | 0 | 0 | 0 | 115.7 | ||
| 981 | I | 37.8 | Very low | 33.1 | Very low | 127 Ų | 127 | 133.8 Ų | 133.8 | 65% | 0.651 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -97.5 | -17.2 | -173.6 | -63.7 | 173.6 | 0 | 0 | 0 | 112.5 | E983 | I981-E983 VanDerWaalsContact C-N 3.33Å; I981-E983 PolarHBondContact O-N 3.41Å |
| 982 | E | 31.8 | Very low | 33.6 | Very low | 136 Ų | 136 | 134 Ų | 134 | 64% | 0.636 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | 4.4 | -169.5 | -140.8 | -164.9 | 120.3 | 0 | 0 | 115.1 | R986 | E982-R986 PolarHBondContact O-NE 3.48Å; E982-R986 PolarHBondContact O-NH2 3.01Å; E982-R986 IonicContact OE1-CZ 3.67Å; E982-R986 VanDerWaalsContact OE1-CZ 3.24Å; E982-R986 IonicContact OE1-NH1 3.71Å; E982-R986 PolarHBondContact OE1-NH1 2.89Å; E982-R986 IonicContact OE1-NH2 2.7Å; E982-R986 PolarHBondContact OE1-NH2 2.85Å |
| 983 | E | 35.7 | Very low | 34 | Very low | 140 Ų | 140 | 133.7 Ų | 133.7 | 65% | 0.654 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.5 | -44.4 | -175.1 | -162.1 | 152.8 | -137 | 0 | 0 | 112.8 | I981 L985 R986 | I981-E983 VanDerWaalsContact C-N 3.33Å; I981-E983 PolarHBondContact O-N 3.41Å; E983-L985 VanDerWaalsContact C-N 3.28Å; E983-L985 PolarHBondContact O-N 2.92Å; E983-R986 PolarHBondContact O-N 3.13Å |
| 984 | H | 38.9 | Very low | 34.6 | Very low | 154 Ų | 154 | 131.4 Ų | 131.4 | 71% | 0.713 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -56.2 | -38.7 | 176.9 | -102.8 | -85.8 | 0 | 0 | 0 | 113.5 | R986 | H984-R986 VanDerWaalsContact C-N 3.34Å; H984-R986 PolarHBondContact O-N 3.36Å |
| 985 | L | 35 | Very low | 35.1 | Very low | 133 Ų | 133 | 129.5 Ų | 129.5 | 70% | 0.696 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -69.6 | -27.3 | 178.9 | -80.5 | 161.8 | 0 | 0 | 0 | 113.4 | E983 | E983-L985 VanDerWaalsContact C-N 3.28Å; E983-L985 PolarHBondContact O-N 2.92Å |
| 986 | R | 33.1 | Very low | 35.5 | Very low | 142 Ų | 142 | 131 Ų | 131 | 54% | 0.536 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -76 | -29 | -178 | -109.8 | -177.8 | -68.8 | -115.6 | -1.7 | 113.2 | E982 E983 H984 | E982-R986 PolarHBondContact O-NE 3.48Å; E982-R986 PolarHBondContact O-NH2 3.01Å; E982-R986 IonicContact OE1-CZ 3.67Å; E982-R986 VanDerWaalsContact OE1-CZ 3.24Å; E982-R986 IonicContact OE1-NH1 3.71Å; E982-R986 PolarHBondContact OE1-NH1 2.89Å; E982-R986 IonicContact OE1-NH2 2.7Å; E982-R986 PolarHBondContact OE1-NH2 2.85Å; E983-R986 PolarHBondContact O-N 3.13Å; H984-R986 VanDerWaalsContact C-N 3.34Å; H984-R986 PolarHBondContact O-N 3.36Å |
| 987 | N | 38.5 | Very low | 35.8 | Very low | 101 Ų | 101 | 133.6 Ų | 133.6 | 54% | 0.54 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -81 | -37.4 | 179.6 | -73.1 | -24 | 0 | 0 | 0 | 112.9 | A989 R990 H991 | N987-A989 VanDerWaalsContact C-N 3.28Å; N987-A989 PolarHBondContact O-N 3.42Å; N987-R990 PolarHBondContact O-N 3.41Å; N987-H991 PolarHBondContact O-N 3.18Å |
| 988 | Y | 38.1 | Very low | 36 | Very low | 176 Ų | 176 | 135.1 Ų | 135.1 | 69% | 0.69 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -63.4 | -30.8 | 175.9 | -110.2 | -80 | 0 | 0 | 0 | 113.6 | N992 | Y988-N992 PolarHBondContact O-ND2 2.86Å |
| 989 | A | 34.6 | Very low | 36.2 | Very low | 59 Ų | 59 | 137.8 Ų | 137.8 | 49% | 0.488 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -63.7 | -48.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | N987 H991 N992 | N987-A989 VanDerWaalsContact C-N 3.28Å; N987-A989 PolarHBondContact O-N 3.42Å; A989-H991 VanDerWaalsContact C-N 3.33Å; A989-H991 PolarHBondContact O-N 3.06Å; A989-N992 PolarHBondContact O-N 3.1Å |
| 990 | R | 34.4 | Very low | 36.3 | Very low | 184 Ų | 184 | 140.6 Ų | 140.6 | 69% | 0.694 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -63.3 | -35 | -176.8 | -67.7 | -172.6 | -176.5 | 178.9 | 4.3 | 113.5 | N987 N992 D993 | N987-R990 PolarHBondContact O-N 3.41Å; R990-N992 VanDerWaalsContact C-N 3.3Å; R990-N992 PolarHBondContact O-N 2.75Å; R990-D993 PolarHBondContact O-N 3.44Å |
| 991 | H | 39.9 | Very low | 36 | Very low | 131 Ų | 131 | 137.6 Ų | 137.6 | 61% | 0.606 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -65.9 | -31.8 | -178.1 | -114.9 | 76.4 | 0 | 0 | 0 | 113.2 | N987 A989 | N987-H991 PolarHBondContact O-N 3.18Å; A989-H991 VanDerWaalsContact C-N 3.33Å; A989-H991 PolarHBondContact O-N 3.06Å |
| 992 | N | 35 | Very low | 35.7 | Very low | 106 Ų | 106 | 142.7 Ų | 142.7 | 57% | 0.567 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -73.7 | -34.7 | -179 | -80.3 | -80.6 | 0 | 0 | 0 | 113.2 | Y988 A989 R990 I994 R996 | Y988-N992 PolarHBondContact O-ND2 2.86Å; A989-N992 PolarHBondContact O-N 3.1Å; R990-N992 VanDerWaalsContact C-N 3.3Å; R990-N992 PolarHBondContact O-N 2.75Å; N992-I994 VanDerWaalsContact C-N 3.34Å; N992-I994 PolarHBondContact O-N 2.71Å; N992-R996 WeakPolarHBondContact O-CB 3.37Å; N992-R996 PolarHBondContact O-N 3.4Å |
| 993 | D | 33.8 | Very low | 35.5 | Very low | 100 Ų | 100 | 141.7 Ų | 141.7 | 54% | 0.535 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -71.1 | -26.4 | 179.8 | -84 | -36 | 0 | 0 | 0 | 113.7 | R990 K997 | R990-D993 PolarHBondContact O-N 3.44Å; D993-K997 PolarHBondContact O-N 2.78Å |
| 994 | I | 43 | Very low | 35.3 | Very low | 102 Ų | 102 | 142 Ų | 142 | 52% | 0.523 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -70.8 | -49.8 | 175 | -61.8 | 174.5 | 0 | 0 | 0 | 109.9 | N992 R996 K997 M998 | N992-I994 VanDerWaalsContact C-N 3.34Å; N992-I994 PolarHBondContact O-N 2.71Å; I994-R996 VanDerWaalsContact C-N 3.27Å; I994-R996 PolarHBondContact O-N 3.05Å; I994-K997 PolarHBondContact O-N 2.83Å; I994-M998 PolarHBondContact O-N 2.85Å |
| 995 | N | 36.8 | Very low | 34.9 | Very low | 109 Ų | 109 | 142.9 Ų | 142.9 | 58% | 0.583 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -62.4 | -32.6 | 176.6 | -89.2 | -47.4 | 0 | 0 | 0 | 112.9 | K997 | N995-K997 VanDerWaalsContact C-N 3.28Å; N995-K997 PolarHBondContact O-N 2.99Å |
| 996 | R | 37.3 | Very low | 34.5 | Very low | 196 Ų | 196 | 146 Ų | 146 | 74% | 0.74 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -67.3 | -24.5 | 173.1 | -175.5 | 172.4 | -82.1 | -173.7 | -5.1 | 113.3 | N992 I994 | N992-R996 WeakPolarHBondContact O-CB 3.37Å; N992-R996 PolarHBondContact O-N 3.4Å; I994-R996 VanDerWaalsContact C-N 3.27Å; I994-R996 PolarHBondContact O-N 3.05Å |
| 997 | K | 35.8 | Very low | 34.4 | Very low | 170 Ų | 170 | 146.4 Ų | 146.4 | 74% | 0.739 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -82.1 | -34.5 | 178.2 | -83.4 | -178 | 175.9 | 177.5 | 0 | 114.3 | D993 I994 N995 K999 | D993-K997 PolarHBondContact O-N 2.78Å; I994-K997 PolarHBondContact O-N 2.83Å; N995-K997 VanDerWaalsContact C-N 3.28Å; N995-K997 PolarHBondContact O-N 2.99Å; K997-K999 VanDerWaalsContact C-N 3.33Å; K997-K999 PolarHBondContact O-N 2.87Å |
| 998 | M | 36.1 | Very low | 34 | Very low | 145 Ų | 145 | 145.7 Ų | 145.7 | 71% | 0.714 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -71.1 | -27.7 | 179.2 | -67.5 | -165.2 | 179.9 | 0 | 0 | 113.1 | I994 K1000 | I994-M998 PolarHBondContact O-N 2.85Å; M998-K1000 PolarHBondContact O-N 2.62Å |
| 999 | K | 34.2 | Very low | 33.6 | Very low | 195 Ų | 195 | 146.1 Ų | 146.1 | 85% | 0.848 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | 19.8 | -174.2 | -134.1 | 168.3 | -171.7 | 171.7 | 0 | 115.6 | K997 | K997-K999 VanDerWaalsContact C-N 3.33Å; K997-K999 PolarHBondContact O-N 2.87Å |
| 1000 | K | 33.8 | Very low | 34 | Very low | 196 Ų | 196 | 148.8 Ų | 148.8 | 85% | 0.852 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.8 | 4 | 179.3 | -101.2 | -171.4 | 174.8 | -173.4 | 0 | 115.3 | M998 | M998-K1000 PolarHBondContact O-N 2.62Š|
| 1001 | S | 33.2 | Very low | 33.9 | Very low | 88 Ų | 88 | 148.6 Ų | 148.6 | 62% | 0.615 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -116.2 | 17.4 | -164.9 | -53.4 | 0 | 0 | 0 | 0 | 116.1 | ||
| 1002 | Y | 31.3 | Very low | 33.4 | Very low | 234 Ų | 234 | 148.2 Ų | 148.2 | 92% | 0.918 | 75% | 0.745 | S | S | * | * | trans | -136.3 | 95.4 | 172.5 | -83 | -75.5 | 0 | 0 | 0 | 112.4 | ||||
| 1003 | S | 27.2 | Very low | 33.3 | Very low | 114 Ų | 114 | 151.3 Ų | 151.3 | 80% | 0.797 | 75% | 0.754 | S | S | * | * | trans | -163.6 | 122.5 | 157.2 | -175.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 1004 | I | 30.6 | Very low | 33 | Very low | 146 Ų | 146 | 153.9 Ų | 153.9 | 75% | 0.749 | 76% | 0.762 | S | S | * | * | trans | 153.3 | 111.3 | 149.7 | -83.1 | 163.6 | 0 | 0 | 0 | 110.6 | ||||
| 1005 | K | 30.4 | Very low | 32.4 | Very low | 174 Ų | 174 | 155.5 Ų | 155.5 | 76% | 0.757 | 77% | 0.772 | S | S | * | * | trans | 53 | 110.7 | 150.2 | -59 | 172.4 | -169.3 | 177.8 | 0 | 119.4 | ||||
| 1006 | H | 27.1 | Very low | 32 | Very low | 197 Ų | 197 | 159.4 Ų | 159.4 | 91% | 0.912 | 78% | 0.783 | S | S | * | * | trans | -87.4 | 148.8 | 133.2 | -107.8 | -93.8 | 0 | 0 | 0 | 109.8 | ||||
| 1007 | I | 31.9 | Very low | 32 | Very low | 151 Ų | 151 | 161.4 Ų | 161.4 | 77% | 0.774 | 81% | 0.808 | S | S | * | * | trans | -110.8 | 156.9 | 168.1 | -69.8 | 174.9 | 0 | 0 | 0 | 107.5 | ||||
| 1008 | A | 30 | Very low | 31.8 | Very low | 87 Ų | 87 | 161 Ų | 161 | 72% | 0.719 | 81% | 0.811 | S | S | * | * | trans | -92.7 | 179.5 | -164 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 1009 | E | 29.3 | Very low | 31.6 | Very low | 184 Ų | 184 | 161.8 Ų | 161.8 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | trans | 76.6 | 151.5 | 167.8 | -58.9 | -164.6 | 163.7 | 0 | 0 | 118.4 | ||||
| 1010 | P | 41.9 | Very low | 31.5 | Very low | 115 Ų | 115 | 159.9 Ų | 159.9 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | cis | -136 | -175.3 | -45.5 | 38.8 | -23.7 | 0 | 0 | 0 | 112.8 | ||||
| 1011 | E | 32.5 | Very low | 31.3 | Very low | 181 Ų | 181 | 157.8 Ų | 157.8 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | trans | -64.7 | 147.6 | 174.7 | -55.2 | -178.3 | 135.4 | 0 | 0 | 113.5 | ||||
| 1012 | S | 31.2 | Very low | 31.2 | Very low | 122 Ų | 122 | 162.2 Ų | 162.2 | 85% | 0.853 | 82% | 0.824 | S | S | * | * | trans | -144.1 | 147.4 | 150.1 | 61.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 1013 | K | 31.6 | Very low | 31.2 | Very low | 172 Ų | 172 | 157.4 Ų | 157.4 | 75% | 0.748 | 82% | 0.818 | S | S | * | * | trans | -96.5 | 171.9 | -162.8 | -58.6 | 177.1 | 179.9 | 177.5 | 0 | 113.5 | ||||
| 1014 | E | 28.6 | Very low | 31.5 | Very low | 153 Ų | 153 | 160.5 Ų | 160.5 | 72% | 0.715 | 82% | 0.82 | S | S | * | * | trans | 90.4 | 142.1 | 134.8 | -97.5 | 168.4 | -134.3 | 0 | 0 | 121.9 | ||||
| 1015 | L | 29.3 | Very low | 31.6 | Very low | 137 Ų | 137 | 161.6 Ų | 161.6 | 72% | 0.717 | 83% | 0.825 | S | S | * | * | trans | 70.9 | 107.2 | 149.2 | -64.7 | 166.8 | 0 | 0 | 0 | 121.2 | ||||
| 1016 | F | 28.6 | Very low | 31.6 | Very low | 190 Ų | 190 | 160.6 Ų | 160.6 | 83% | 0.833 | 83% | 0.831 | S | S | * | * | 34.7 | 116 | 128.7 | -81.5 | -94.3 | 0 | 0 | 0 | 119.7 | |||||
| 1017 | L | 37.8 | Very low | 32.1 | Very low | 238 Ų | 238 | 157.3 Ų | 157.3 | 100% | 1.246 | 82% | 0.823 | S | S | * | * | -156.2 | 0 | 107.8 | -112.8 | 166.6 | 0 | 0 | 0 | 112.3 |
Retrieved 1,017 of 1,017 residues in 1083.2 ms
(Link to these results)