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DCartddg.Mlog
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DCartddg.Mlog
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# Current Positives|Negatives threshold (thr) is 0 (ddG >= 0 are not-destabilizing [positives] and ddG < 0 are destabilizing [negatives]).
aa S D T TP avg err FP TN avg err FN P N SEN SPE PPV NPV ACC accn RMSE MAE PCC Sc Ob1 Ob2 MCC
X 89 253 342 50 0.7 1.3 21 232 -1.7 3.0 39 71 271 0.562 0.917 0.704 0.856 0.825 0.739 3.321 2.661 0.675 57.9 40.4 1.8 0.52
A 20 77 97 13 1.2 2.2 6 71 -2.1 3.6 7 19 78 0.650 0.922 0.684 0.910 0.866 0.786 3.920 3.422 0.681 63.9 33.0 3.1 0.58
V 26 80 106 12 0.4 1.4 7 73 -1.4 2.8 14 19 87 0.462 0.912 0.632 0.839 0.802 0.687 2.973 2.403 0.708 52.8 47.2 0.0 0.42
I 10 58 68 4 0.7 1.5 3 55 -1.6 3.6 6 7 61 0.400 0.948 0.571 0.902 0.868 0.674 3.979 3.442 0.705 58.8 39.7 1.5 0.41
L 10 31 41 5 0.6 1.1 3 28 -1.7 3.0 5 8 33 0.500 0.903 0.625 0.848 0.805 0.702 3.259 2.706 0.750 61.0 39.0 0.0 0.44
M 7 32 39 3 0.5 1.2 2 30 -1.3 3.5 4 5 34 0.429 0.938 0.600 0.882 0.846 0.683 3.808 3.154 0.486 56.4 43.6 0.0 0.42
F 7 28 35 4 0.5 1.8 2 26 -1.4 3.1 3 6 29 0.571 0.929 0.667 0.897 0.857 0.750 3.800 2.935 0.528 57.1 42.9 0.0 0.53
W 0 3 3 0 0.0 0.0 0 3 -3.5 3.6 0 0 3 0.000 1.000 0.000 1.000 1.000 0.500 4.127 3.567 -0.702 100.0 0.0 0.0 0.00
Y 2 17 19 2 0.2 0.1 1 16 -1.8 2.0 0 3 16 1.000 0.941 0.667 1.000 0.947 0.971 2.321 1.687 0.793 63.2 36.8 0.0 0.79
R 3 17 20 1 0.2 0.1 1 16 -2.2 2.9 2 2 18 0.333 0.941 0.500 0.889 0.850 0.637 3.026 2.418 0.745 80.0 20.0 0.0 0.33
H 4 2 6 2 1.7 0.3 0 2 -2.6 1.8 2 2 4 0.500 1.000 1.000 0.500 0.667 0.750 2.540 1.857 0.832 50.0 50.0 0.0 0.50
K 7 10 17 3 1.0 0.7 2 8 -1.9 1.5 4 5 12 0.429 0.800 0.600 0.667 0.647 0.614 2.257 1.567 0.706 47.1 47.1 5.9 0.25
D 16 12 28 11 1.3 1.0 0 12 -1.4 3.3 5 11 17 0.688 1.000 1.000 0.706 0.821 0.844 3.392 2.438 0.614 53.6 42.9 3.6 0.70
E 8 8 16 4 0.3 1.0 1 7 -1.0 2.1 4 5 11 0.500 0.875 0.800 0.636 0.688 0.688 2.346 1.702 0.782 50.0 50.0 0.0 0.40
S 15 30 45 13 0.4 1.0 4 26 -1.3 2.3 2 17 28 0.867 0.867 0.765 0.929 0.867 0.867 2.389 1.858 0.827 57.8 40.0 2.2 0.71
T 13 40 53 8 0.4 1.2 4 36 -1.5 1.5 5 12 41 0.615 0.900 0.667 0.878 0.830 0.758 2.218 1.699 0.656 58.5 39.6 1.9 0.53
N 11 13 24 8 0.6 0.6 3 10 -1.6 2.0 3 11 13 0.727 0.769 0.727 0.769 0.750 0.748 2.251 1.603 0.706 54.2 41.7 4.2 0.50
Q 3 6 9 1 0.2 2.4 0 6 -0.8 2.8 2 1 8 0.333 1.000 1.000 0.750 0.778 0.667 3.056 2.434 0.779 55.6 44.4 0.0 0.50
C 2 12 14 0 0.0 0.0 1 11 -2.1 3.9 2 1 13 0.000 0.917 0.000 0.846 0.786 0.458 4.491 3.946 0.049 71.4 21.4 7.1 -0.11
G 7 23 30 2 1.1 1.9 1 22 -1.9 3.2 5 3 27 0.286 0.957 0.667 0.815 0.800 0.621 3.638 3.201 0.716 50.0 46.7 3.3 0.34
P 7 7 14 4 0.6 1.7 1 6 -1.8 4.9 3 5 9 0.571 0.857 0.800 0.667 0.714 0.714 4.300 3.782 0.663 42.9 50.0 7.1 0.45
p 0 0 0 0 0.0 0.0 0 0 0.0 0.0 0 0 0 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.0 0.0 0.0 0.00
sb 8 7 15 7 0.8 1.8 1 6 -2.6 5.4 1 8 7 0.875 0.857 0.875 0.857 0.867 0.866 3.861 3.178 0.903 80.0 20.0 0.0 0.73
bs 4 36 40 1 1.9 1.1 1 35 -2.9 4.2 3 2 38 0.250 0.972 0.500 0.921 0.900 0.611 4.491 4.140 0.644 82.5 12.5 5.0 0.31
pn 1 6 7 0 0.0 0.0 1 5 -1.8 2.9 1 1 6 0.000 0.833 0.000 0.833 0.714 0.417 3.100 2.237 0.920 85.7 14.3 0.0 -0.17
np 2 0 2 1 2.3 0.1 0 0 0.0 0.0 1 1 1 0.000 0.000 1.000 0.000 0.500 0.000 3.380 2.415 1.000 50.0 50.0 0.0 0.00
wh 5 10 15 3 2.4 1.5 2 8 -1.8 1.9 2 5 10 0.600 0.800 0.600 0.800 0.733 0.700 3.544 2.601 0.253 53.3 33.3 13.3 0.40
hw 6 10 16 2 0.2 0.5 0 10 -1.8 2.6 4 2 14 0.333 1.000 1.000 0.714 0.750 0.667 2.910 2.264 0.668 62.5 37.5 0.0 0.49
nh 21 33 54 13 0.4 1.5 6 27 -1.4 1.3 8 19 35 0.619 0.818 0.684 0.771 0.741 0.719 2.214 1.755 0.484 42.6 55.6 1.9 0.45
hn 4 31 35 3 0.5 2.0 2 29 -1.7 3.0 1 5 30 0.750 0.935 0.600 0.967 0.914 0.843 3.225 2.757 0.875 60.0 40.0 0.0 0.62
nw 8 8 16 7 0.3 0.6 2 6 -1.3 1.5 1 9 7 0.875 0.750 0.778 0.857 0.812 0.812 1.634 0.869 0.885 75.0 25.0 0.0 0.63
wn 5 10 15 2 2.1 0.6 1 9 -2.5 3.5 3 3 12 0.400 0.900 0.667 0.750 0.733 0.650 3.687 3.048 0.800 53.3 40.0 6.7 0.35
h0 33 159 192 15 0.6 1.7 9 150 -1.7 3.5 18 24 168 0.455 0.943 0.625 0.893 0.859 0.699 3.737 3.164 0.701 62.0 37.5 0.5 0.45
n0 20 31 51 12 1.4 1.0 4 27 -1.9 2.7 8 16 35 0.600 0.871 0.750 0.771 0.765 0.735 3.155 2.377 0.642 51.0 43.1 5.9 0.50
w0 34 59 93 23 0.4 1.1 8 51 -1.5 1.6 11 31 62 0.676 0.864 0.742 0.823 0.796 0.770 2.332 1.751 0.592 52.7 45.2 2.2 0.55
0h 49 162 211 26 0.8 1.6 15 147 -1.6 3.2 23 41 170 0.531 0.907 0.634 0.865 0.820 0.719 3.552 2.918 0.608 56.4 41.7 1.9 0.47
0w 25 29 54 15 0.5 0.6 3 26 -1.5 2.3 10 18 36 0.600 0.897 0.833 0.722 0.759 0.748 2.333 1.625 0.765 63.0 37.0 0.0 0.53
0n 14 60 74 8 1.0 1.1 3 57 -1.8 2.9 6 11 63 0.571 0.950 0.727 0.905 0.878 0.761 3.306 2.743 0.787 59.5 37.8 2.7 0.57
pp 0 2 2 0 0.0 0.0 0 2 -1.6 3.3 0 0 2 0.000 1.000 0.000 1.000 1.000 0.500 3.315 3.314 1.000 50.0 50.0 0.0 0.00
nn 0 0 0 0 0.0 0.0 0 0 0.0 0.0 0 0 0 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.0 0.0 0.0 0.00
X # A # V # I # L # M # F # W # Y # R # H # K # D # E # S # T # N # Q # C # G # P #
X 0.7 342 0.6 75 0.8 34 0.6 20 0.6 21 0.5 27 0.5 22 -0.7 3 0.8 7 0.5 5 0.8 4 0.8 6 0.9 12 0.9 13 0.8 25 0.8 8 0.7 18 1.0 3 0.1 9 0.8 21 0.9 9
A 0.9 22 0 0 0.9 4 * 1 * 2 0 0 * 2 * 1 0 0 0 0 0 0 0 0 0 0 0 0 1.0 9 0 0 0 0 0 0 * 1 0 0 * 2
V 0.7 72 0.8 14 0 0 0.6 10 -0.8 7 0.7 8 0.9 3 0 0 -0.9 3 0.6 3 0 0 * 1 0.8 4 * 1 1.0 4 1.0 3 0.9 3 0 0 * 2 0.8 5 * 1
I 0.7 48 0.3 15 0.1 16 0 0 -0.8 3 0.5 8 0 0 0 0 * 1 0 0 0 0 0 0 0 0 0 0 0 0 * 2 0 0 0 0 * 1 * 1 * 1
L 0.8 20 0.0 7 * 2 * 2 0 0 0.2 7 * 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
M 0.6 12 * 1 0 0 * 2 0.0 5 0 0 * 1 0 0 * 1 0 0 0 0 * 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
F 0.5 13 0.6 4 * 1 * 1 * 2 * 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 * 2 * 1 0 0 0 0 0 0
W 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
Y 0.9 12 * 1 0 0 0 0 0 0 0 0 0.1 10 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 * 1 0 0
R 0.6 15 * 1 * 1 0 0 0 0 * 1 0 0 * 1 * 1 0 0 * 1 * 1 * 1 1.0 3 * 1 0 0 * 1 * 1 0 0 * 1 0 0
H * 2 * 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 * 1
K 0.0 11 -0.1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1.0 3 0 0 0 0 * 1 0 0 0 0 0.4 3 * 1
D 0.6 16 0.3 7 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 * 1 0 0 0 0 0 0 * 1 0 0 0.6 5 0 0 0 0 0 0 * 2
E 0.4 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 * 1 0 0 0 0 0 0 0 0 0 0 * 1 * 1 0 0 0 0 0 0
S 0.7 20 0.2 5 * 1 * 1 * 1 0 0 * 2 0 0 0 0 * 1 0 0 * 1 * 1 * 1 0 0 * 2 * 2 0 0 0 0 * 1 * 1
T 0.6 45 -0.1 4 0.5 9 -0.2 3 * 1 0 0 * 1 0 0 0 0 * 1 * 1 0 0 1.0 3 * 2 0.9 9 0 0 0.9 3 0 0 -0.3 5 1.0 3 0 0
N 0.9 6 * 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 * 2 * 1 0 0 0 0 0 0 0 0 0 0 * 2 0 0
Q 0.9 6 * 1 0 0 0 0 0 0 * 1 0 0 0 0 0 0 0 0 0 0 * 1 0 0 * 2 0 0 0 0 0 0 0 0 0 0 * 1 0 0
C -0.5 5 * 1 0 0 0 0 0 0 0 0 * 1 * 1 * 1 0 0 0 0 0 0 0 0 0 0 * 1 0 0 0 0 0 0 0 0 0 0 0 0
G 0.6 9 0.5 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 * 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
P 0.4 5 * 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 * 1 0 0 0 0 0 0 0.2 3 0 0