N | Peptide | ΔE# kJ/mol | ΔE kJ/mol | P1 CO | P1 OH | P1 NH | P1 CN | P* CO | P* OH | P* NH | P* CN | P2 CO | P2 OH | P2 NH | P2 CN |
1 | avhala | 10.5 | −16.3 | 0.86 | 0.21 | 0.68 | 0.57 | 0.68 | 0.43 | 0.44 | 0.77 | 0.48 | 0.70 | 0.19 | 0.99 |
2 | avhgly | 24.5 | −72.2 | 0.85 | 0.15 | 0.75 | 0.52 | 0.72 | 0.30 | 0.57 | 0.71 | 0.48 | 0.70 | 0.19 | 1.03 |
3 | avhasn | 11.8 | −16.8 | 0.83 | 0.14 | 0.76 | 0.48 | 0.81 | 0.18 | 0.71 | 0.51 | 0.44 | 0.58 | 0.28 | 0.89 |
4 | avhser | 34.9 | −0.02 | 0.91 | 0.18 | 0.72 | 0.51 | 0.65 | 0.50 | 0.38 | 0.84 | 0.50 | 0.70 | 0.20 | 1.00 |
5 | avhcys | 79.0 | −36.7 | 0.79 | 0.28 | 0.58 | 0.70 | 0.67 | 0.40 | 0.46 | 0.83 | 0.46 | 0.69 | 0.19 | 1.01 |
6 | avhmet | 3.2 | −60.9 | 0.76 | 0.18 | 0.71 | 0.53 | 0.58 | 0.36 | 0.51 | 0.77 | 0.39 | 0.70 | 0.20 | 1.00 |
7 | avhasp | 24.6 | −131.2 | 0.88 | 0.16 | 0.72 | 0.53 | 0.84 | 0.19 | 0.68 | 0.58 | 0.45 | 0.70 | 0.19 | 0.93 |
8 | avhgln | 91.6 | −139.1 | 0.84 | 0.13 | 0.76 | 0.43 | 0.65 | 0.31 | 0.54 | 0.60 | 0.33 | 0.72 | 0.20 | 1.01 |
9 | avhglu | 192.9 | 144.1 | 0.83 | 0.15 | 0.75 | 0.50 | 0.68 | 0.29 | 0.58 | 0.67 | 0.58 | 0.41 | 0.47 | 0.79 |
10 | avhthr | 86.9 | 67.2 | 0.84 | 0.14 | 0.74 | 0.57 | 0.56 | 0.46 | 0.41 | 0.86 | 0.43 | 0.69 | 0.23 | 0.89 |
11 | avhlys | 56.5 | −78.1 | 0.83 | 0.13 | 0.75 | 0.50 | 0.58 | 0.35 | 0.51 | 0.71 | 0.47 | 0.69 | 0.19 | 0.97 |
12 | avhoxylys | 50.5 | −7.2 | 0.91 | 0.15 | 0.74 | 0.54 | 0.55 | 0.50 | 0.35 | 0.90 | 0.47 | 0.68 | 0.19 | 1.00 |
13 | avhphe | 25.5 | −48.1 | 0.89 | 0.15 | 0.74 | 0.56 | 0.64 | 0.38 | 0.48 | 0.79 | 0.46 | 0.69 | 0.19 | 1.00 |
14 | avhtyr | 10.9 | −7.0 | 0.79 | 0.28 | 0.58 | 0.60 | 0.67 | 0.42 | 0.44 | 0.74 | 0.45 | 0.69 | 0.18 | 0.97 |
15 | avhtrp | 279.6 | 262.2 | 0.73 | 0.21 | 0.66 | 0.63 | 0.39 | 0.54 | 0.34 | 0.78 | 0.34 | 0.62 | 0.28 | 0.84 |
16 | avhhis | 1.1 | −28.9 | 0.80 | 0.27 | 0.59 | 0.68 | 0.74 | 0.34 | 0.46 | 0.75 | 0.46 | 0.69 | 0.20 | 1.03 |
17 | avhval | 2.1 | −22.9 | 0.79 | 0.28 | 0.61 | 0.62 | 0.68 | 0.42 | 0.48 | 0.76 | 0.48 | 0.71 | 0.20 | 0.98 |
18 | avhleu | 28.4 | −60.7 | 0.86 | 0.11 | 0.79 | 0.42 | 0.77 | 0.22 | 0.64 | 0.61 | 0.46 | 0.69 | 0.19 | 0.97 |
19 | avhileu | 13.2 | −157.6 | 0.83 | 0.14 | 0.75 | 0.54 | 0.77 | 0.17 | 0.70 | 0.60 | 0.50 | 0.69 | 0.18 | 0.97 |
20 | avharg | 34.1 | −191.6 | 0.71 | 0.23 | 0.64 | 0.54 | 0.61 | 0.30 | 0.56 | 0.64 | 0.31 | 0.59 | 0.27 | 0.90 |