#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pmp s LEU 2 N 0.00 4.38 0.37 1.09 1.43 -1.26 -4.97 118.68 119.72 2pmp s LEU 2 Ca 0.00 1.19 0.11 0.00 -1.03 0.00 0.00 54.13 54.39 2pmp s LEU 2 Cb 0.00 -3.00 0.74 0.00 0.03 0.00 0.00 46.19 43.95 2pmp s LEU 2 CO 0.00 0.01 1.86 1.55 0.23 0.00 0.00 176.35 180.00 2pmp h PRO 3 N 6.06 0.12 -5.11 1.29 0.13 -1.97 -3.41 132.00 129.12 2pmp h PRO 3 Ca -0.43 -0.04 -0.42 0.00 -0.87 0.00 0.00 66.00 64.24 2pmp h PRO 3 Cb 1.20 -0.01 -0.26 0.00 0.13 0.00 0.00 31.00 32.06 2pmp h PRO 3 CO 0.72 0.39 -0.79 -0.06 -0.23 0.00 0.00 178.00 178.03 2pmp s PHE 4 N -4.43 1.08 -0.05 1.56 0.08 -1.26 -1.09 117.98 113.87 2pmp s PHE 4 Ca -0.04 -0.31 0.01 0.00 0.12 0.00 0.00 56.93 56.71 2pmp s PHE 4 Cb 0.15 -0.66 0.02 0.00 -0.57 0.00 0.00 43.02 41.96 2pmp s PHE 4 CO 0.73 0.01 -0.04 1.03 -0.10 0.00 0.00 175.22 176.85 2pmp s ARG 5 N -0.89 0.80 -0.09 0.44 0.52 -0.56 -4.98 118.95 114.20 2pmp s ARG 5 Ca 0.01 -0.08 -0.12 0.00 -0.52 0.00 0.00 55.73 55.03 2pmp s ARG 5 Cb -0.07 -0.86 -0.05 0.00 0.52 0.00 0.00 34.95 34.49 2pmp s ARG 5 CO 0.01 -0.11 0.28 -1.50 0.02 0.00 0.00 175.30 174.00 2pmp s ILE 6 N 1.06 5.27 0.07 1.52 2.07 -1.26 -0.23 121.20 129.71 2pmp s ILE 6 Ca -0.09 0.54 0.05 0.00 -1.41 0.00 0.00 60.65 59.74 2pmp s ILE 6 Cb -0.14 -3.58 -0.03 0.00 0.13 0.00 0.00 42.46 38.84 2pmp s ILE 6 CO -0.01 0.54 -0.14 -0.83 -1.91 0.00 0.00 174.94 172.59 2pmp s GLY 7 N -0.59 0.87 -0.05 1.50 0.00 -0.12 -4.07 107.32 104.86 2pmp s GLY 7 Ca 0.19 -1.01 0.02 0.00 0.00 0.00 0.00 44.72 43.91 2pmp s GLY 7 CO 0.07 -1.04 -0.08 -1.58 0.00 0.00 0.00 173.10 170.47 2pmp s HIS 8 N -1.31 1.02 0.13 1.90 5.04 -1.26 -1.35 115.29 119.46 2pmp s HIS 8 Ca -0.02 -0.32 0.11 0.00 -1.54 0.00 0.00 55.06 53.29 2pmp s HIS 8 Cb -0.10 -0.80 -0.04 0.00 0.04 0.00 0.00 32.58 31.68 2pmp s HIS 8 CO 0.02 -0.20 -0.26 0.20 -2.34 0.00 0.00 174.74 172.16 2pmp s GLY 9 N 0.70 1.53 -0.01 1.59 0.00 0.68 -4.14 107.32 107.66 2pmp s GLY 9 Ca -0.11 -1.44 0.02 0.00 0.00 0.00 0.00 44.72 43.18 2pmp s GLY 9 CO 0.02 -1.42 -0.05 -0.12 0.00 0.00 0.00 173.10 171.53 2pmp s PHE 10 N -1.07 0.50 -0.00 1.90 5.36 -1.26 -0.76 117.98 122.65 2pmp s PHE 10 Ca 0.13 -0.10 -0.12 0.00 -0.96 0.00 0.00 56.93 55.89 2pmp s PHE 10 Cb -0.10 -0.35 0.01 0.00 -0.34 0.00 0.00 43.02 42.25 2pmp s PHE 10 CO 0.06 -0.03 0.24 0.34 -1.46 0.00 0.00 175.22 174.37 2pmp s ASP 11 N 0.02 -0.10 -0.01 6.13 2.15 -0.36 -4.79 116.67 119.71 2pmp s ASP 11 Ca 0.00 -0.06 -0.00 0.00 0.43 0.00 0.00 52.55 52.92 2pmp s ASP 11 Cb -0.04 0.27 0.01 0.00 -0.30 0.00 0.00 42.92 42.86 2pmp s ASP 11 CO -0.00 -0.43 0.02 -0.22 -0.17 0.00 0.00 175.17 174.36 2pmp s LEU 12 N -1.43 1.81 0.09 -1.34 0.20 -1.26 -0.48 118.68 116.26 2pmp s LEU 12 Ca -0.13 0.04 0.05 0.00 0.69 0.00 0.00 54.13 54.78 2pmp s LEU 12 Cb -0.06 0.04 -0.03 0.00 -0.43 0.00 0.00 46.19 45.71 2pmp s LEU 12 CO 0.03 -0.02 -0.14 -1.00 -0.29 0.00 0.00 176.35 174.92 2pmp s HIS 13 N 0.17 1.29 0.25 5.38 3.76 0.11 -4.99 115.29 121.26 2pmp s HIS 13 Ca -0.01 -0.49 -0.30 0.00 -0.15 0.00 0.00 55.06 54.11 2pmp s HIS 13 Cb -0.02 -0.71 -0.09 0.00 1.11 0.00 0.00 32.58 32.87 2pmp s HIS 13 CO -0.00 0.08 1.23 1.03 -0.85 0.00 0.00 174.74 176.23 2pmp s ARG 14 N -2.00 4.47 -0.18 1.40 0.52 -1.26 -0.97 118.95 120.92 2pmp s ARG 14 Ca 0.01 1.99 -0.06 0.00 -0.52 0.00 0.00 55.73 57.16 2pmp s ARG 14 Cb -0.09 -3.17 -0.03 0.00 0.52 0.00 0.00 34.95 32.18 2pmp s ARG 14 CO 0.02 -0.08 0.01 -0.51 0.02 0.00 0.00 175.30 174.77 2pmp s LEU 15 N -0.91 3.46 0.12 2.53 1.43 -0.57 -2.01 118.68 122.72 2pmp s LEU 15 Ca 0.51 -0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.55 2pmp s LEU 15 Cb -0.35 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 2pmp s LEU 15 CO 0.42 0.13 -0.08 -1.61 0.23 0.00 0.00 176.35 175.44 2pmp s GLU 16 N 0.62 0.93 0.34 1.70 0.41 -0.06 -4.53 118.70 118.10 2pmp s GLU 16 Ca 0.00 -1.37 -0.29 0.00 -0.41 0.00 0.00 54.97 52.91 2pmp s GLU 16 Cb -0.14 -0.40 -0.11 0.00 -1.78 0.00 0.00 34.13 31.70 2pmp s GLU 16 CO 0.02 0.03 1.50 -2.14 -0.49 0.00 0.00 175.26 174.18 2pmp s PRO 17 N -3.70 4.14 0.00 0.39 0.02 -1.26 -1.41 135.00 133.18 2pmp s PRO 17 Ca 0.13 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.68 2pmp s PRO 17 Cb 0.03 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.56 2pmp s PRO 17 CO -0.02 -0.53 0.00 0.41 -0.33 0.00 0.00 177.00 176.53 2pmp n GLY 18 N 1.01 0.79 3.97 0.52 0.00 -1.12 -4.86 105.19 105.49 2pmp n GLY 18 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 2pmp n GLY 18 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2pmp s TYR 19 N -2.98 3.27 0.27 1.61 2.02 -1.23 -4.94 117.35 115.37 2pmp s TYR 19 Ca 0.00 0.07 -0.30 0.00 -0.37 0.00 0.00 57.07 56.47 2pmp s TYR 19 Cb 0.00 -2.02 -0.10 0.00 -0.40 0.00 0.00 41.96 39.44 2pmp s TYR 19 CO 0.00 -0.03 1.36 -2.14 -1.57 0.00 0.00 175.55 173.17 2pmp s PRO 20 N -4.30 4.33 -0.43 -1.71 0.02 -1.26 -3.11 135.00 128.54 2pmp s PRO 20 Ca 0.43 2.21 -0.05 0.00 0.02 0.00 0.00 61.00 63.61 2pmp s PRO 20 Cb -0.10 -3.12 0.11 0.00 0.02 0.00 0.00 34.50 31.42 2pmp s PRO 20 CO 0.34 -0.29 0.25 -1.17 -0.33 0.00 0.00 177.00 175.79 2pmp s LEU 21 N -0.81 5.34 -0.18 -5.54 2.96 -1.26 -0.18 118.68 119.01 2pmp s LEU 21 Ca 0.55 -1.93 -0.01 0.00 -0.22 0.00 0.00 54.13 52.52 2pmp s LEU 21 Cb -0.40 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.40 2pmp s LEU 21 CO 0.45 -0.58 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.13 2pmp s ILE 22 N 1.23 2.63 -0.19 6.68 1.01 -1.26 -0.85 121.20 130.46 2pmp s ILE 22 Ca 0.07 -0.76 -0.00 0.00 0.00 0.00 0.00 60.65 59.96 2pmp s ILE 22 Cb -0.24 -2.14 0.05 0.00 0.01 0.00 0.00 42.46 40.14 2pmp s ILE 22 CO -0.03 0.50 -0.06 -0.63 0.00 0.00 0.00 174.94 174.73 2pmp s ILE 23 N 1.17 1.26 -1.52 2.92 1.01 0.12 -4.31 121.20 121.86 2pmp s ILE 23 Ca 0.02 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 59.78 2pmp s ILE 23 Cb -0.14 -1.46 0.01 0.00 0.01 0.00 0.00 42.46 40.88 2pmp s ILE 23 CO -0.06 0.06 0.72 0.61 0.00 0.00 0.00 174.94 176.28 2pmp n GLY 24 N 4.81 -0.53 1.25 6.18 0.00 -1.26 -2.11 105.19 113.52 2pmp n GLY 24 Ca -0.12 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2pmp n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pmp n GLY 25 N -1.61 2.02 3.75 -0.02 0.00 -1.26 -4.26 105.19 103.81 2pmp n GLY 25 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 2pmp n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pmp s ILE 26 N -2.33 5.39 0.01 -0.61 -1.09 -0.90 -5.06 121.20 116.62 2pmp s ILE 26 Ca 0.00 0.18 -0.30 0.00 -2.23 0.00 0.00 60.65 58.30 2pmp s ILE 26 Cb 0.00 -3.44 -0.04 0.00 -1.58 0.00 0.00 42.46 37.40 2pmp s ILE 26 CO 0.00 0.47 1.10 -0.69 -1.23 0.00 0.00 174.94 174.60 2pmp s VAL 27 N 0.10 4.44 -0.16 2.92 1.01 -1.26 -0.70 120.40 126.75 2pmp s VAL 27 Ca 0.09 1.75 0.00 0.00 0.00 0.00 0.00 61.98 63.83 2pmp s VAL 27 Cb -0.11 -4.12 0.03 0.00 0.00 0.00 0.00 36.38 32.17 2pmp s VAL 27 CO -0.01 0.10 -0.14 -0.63 0.00 0.00 0.00 175.10 174.43 2pmp s ILE 28 N 1.30 1.61 0.41 2.22 1.01 -0.03 -4.98 121.20 122.72 2pmp s ILE 28 Ca 0.55 -0.73 -0.26 0.00 0.00 0.00 0.00 60.65 60.21 2pmp s ILE 28 Cb -0.25 -1.55 -0.09 0.00 0.01 0.00 0.00 42.46 40.59 2pmp s ILE 28 CO 0.27 0.40 1.27 -2.16 0.00 0.00 0.00 174.94 174.72 2pmp s PRO 29 N 1.46 3.98 -0.21 2.79 0.04 -1.26 -4.25 135.00 137.55 2pmp s PRO 29 Ca 0.04 2.08 -0.30 0.00 0.04 0.00 0.00 61.00 62.86 2pmp s PRO 29 Cb -0.14 -2.73 0.15 0.00 0.04 0.00 0.00 34.50 31.82 2pmp s PRO 29 CO -0.10 -0.46 1.12 -1.58 0.04 0.00 0.00 177.00 176.02 2pmp s HIS 30 N -1.30 -0.26 -0.28 0.56 2.46 -1.26 -4.90 115.29 110.32 2pmp s HIS 30 Ca 0.57 0.45 0.19 0.00 0.47 0.00 0.00 55.06 56.74 2pmp s HIS 30 Cb -0.36 0.46 1.05 0.00 -0.13 0.00 0.00 32.58 33.61 2pmp s HIS 30 CO 0.46 -0.23 1.59 -0.40 -2.47 0.00 0.00 174.74 173.69 2pmp n ASP 31 N 0.70 0.50 -4.06 9.88 5.75 -1.26 -4.67 116.55 123.39 2pmp n ASP 31 Ca -0.07 0.74 -0.10 0.00 -0.01 0.00 0.00 54.79 55.35 2pmp n ASP 31 Cb 0.58 -0.80 -0.11 0.00 -1.03 0.00 0.00 41.12 39.76 2pmp n ASP 31 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2pmp s ARG 32 N -3.49 0.53 0.21 0.11 0.52 -1.26 -2.81 118.95 112.76 2pmp s ARG 32 Ca -0.02 -0.92 -0.05 0.00 -0.52 0.00 0.00 55.73 54.22 2pmp s ARG 32 Cb 0.06 -0.04 0.02 0.00 0.52 0.00 0.00 34.95 35.50 2pmp s ARG 32 CO 0.18 -0.03 0.37 0.41 0.02 0.00 0.00 175.30 176.25 2pmp n GLY 33 N 0.94 1.96 3.66 -3.53 0.00 -0.50 -4.61 105.19 103.11 2pmp n GLY 33 Ca -0.19 -1.33 -0.43 0.00 0.00 0.00 0.00 46.02 44.07 2pmp n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pmp s GLU 35 N 3.32 3.13 0.22 0.00 2.12 -0.85 -4.44 118.70 122.19 2pmp s GLU 35 Ca 0.51 -0.90 -0.14 0.00 0.36 0.00 0.00 54.97 54.80 2pmp s GLU 35 Cb -0.19 -4.17 0.01 0.00 0.26 0.00 0.00 34.13 30.04 2pmp s GLU 35 CO 0.12 -1.48 0.48 0.00 -0.54 0.00 0.00 175.26 173.84 2pmp s ALA 36 N 3.15 -0.45 0.07 6.30 0.00 -1.26 -4.53 121.76 125.03 2pmp s ALA 36 Ca 0.18 -0.67 0.02 0.00 0.00 0.00 0.00 51.96 51.49 2pmp s ALA 36 Cb -0.19 0.96 -0.25 0.00 0.00 0.00 0.00 23.12 23.64 2pmp s ALA 36 CO 0.11 -0.82 1.09 0.45 0.00 0.00 0.00 175.76 176.59 2pmp h HIS 37 N 2.27 0.26 -1.77 0.00 3.86 -1.96 -3.46 115.15 114.35 2pmp h HIS 37 Ca -0.27 -0.19 -0.12 0.00 -1.16 0.00 0.00 60.37 58.63 2pmp h HIS 37 Cb 1.25 -0.01 0.07 0.00 1.06 0.00 0.00 27.41 29.78 2pmp h HIS 37 CO 0.39 1.18 -0.03 -1.13 0.86 0.00 0.00 177.93 179.20 2pmp n SER 38 N -3.41 -2.26 0.00 2.45 3.41 -1.26 -4.82 113.62 107.73 2pmp n SER 38 Ca -0.08 -0.42 0.14 0.00 -0.26 0.00 0.00 58.87 58.25 2pmp n SER 38 Cb 1.00 -0.32 0.79 0.00 -0.26 0.00 0.00 64.21 65.42 2pmp n SER 38 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2pmp n ASP 39 N -3.81 0.00 0.00 4.04 5.75 -1.26 -4.94 116.55 116.34 2pmp n ASP 39 Ca 0.05 -0.57 0.00 0.00 -0.01 0.00 0.00 54.79 54.25 2pmp n ASP 39 Cb 0.19 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 2pmp n ASP 39 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pmp n GLY 40 N 0.92 0.60 3.55 6.12 0.00 -1.26 -4.68 105.19 110.43 2pmp n GLY 40 Ca 0.18 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 2pmp n GLY 40 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2pmp s ASP 41 N -2.27 6.53 0.37 1.61 -1.08 -1.26 -4.82 116.67 115.75 2pmp s ASP 41 Ca 0.00 -1.55 0.04 0.00 -0.52 0.00 0.00 52.55 50.52 2pmp s ASP 41 Cb 0.00 -2.56 0.73 0.00 -1.46 0.00 0.00 42.92 39.63 2pmp s ASP 41 CO 0.00 -1.46 2.02 1.62 0.52 0.00 0.00 175.17 177.88 2pmp h VAL 42 N 6.65 1.13 -0.11 1.11 3.04 -1.93 -0.74 116.25 125.40 2pmp h VAL 42 Ca 0.21 -0.25 -0.10 0.00 -1.01 0.00 0.00 66.70 65.55 2pmp h VAL 42 Cb 1.00 0.32 0.00 0.00 -2.01 0.00 0.00 31.29 30.61 2pmp h VAL 42 CO 1.41 0.13 -0.31 0.25 -1.01 0.00 0.00 177.57 178.04 2pmp h LEU 43 N 0.74 0.47 -0.38 3.16 5.85 -1.89 -2.17 115.31 121.08 2pmp h LEU 43 Ca 0.21 -0.59 -0.05 0.00 0.84 0.00 0.00 57.88 58.29 2pmp h LEU 43 Cb -0.05 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 2pmp h LEU 43 CO -0.05 0.98 0.06 -0.07 -0.34 0.00 0.00 178.44 179.02 2pmp h LEU 44 N -0.02 0.61 -1.16 2.25 4.07 -1.85 -1.94 115.31 117.28 2pmp h LEU 44 Ca -0.01 -0.26 -0.04 0.00 0.08 0.00 0.00 57.88 57.65 2pmp h LEU 44 Cb 0.92 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 42.48 2pmp h LEU 44 CO 0.07 0.72 0.16 0.45 -1.08 0.00 0.00 178.44 178.76 2pmp h HIS 45 N 0.48 0.77 0.00 1.13 3.86 -1.18 -2.02 115.15 118.19 2pmp h HIS 45 Ca 0.12 -0.05 -0.09 0.00 -1.16 0.00 0.00 60.37 59.18 2pmp h HIS 45 Cb 0.37 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 2pmp h HIS 45 CO 0.03 0.62 -0.79 0.00 0.86 0.00 0.00 177.93 178.65 2pmp h VAL 47 N 0.00 1.20 -0.52 0.00 2.07 -1.26 -1.66 116.25 116.08 2pmp h VAL 47 Ca -0.05 -0.65 0.05 0.00 0.82 0.00 0.00 66.70 66.87 2pmp h VAL 47 Cb 1.33 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.97 2pmp h VAL 47 CO 0.04 0.23 0.26 0.58 0.02 0.00 0.00 177.57 178.70 2pmp h VAL 48 N 0.47 0.94 0.00 2.57 2.07 -1.34 -1.69 116.25 119.27 2pmp h VAL 48 Ca 0.12 -0.17 -0.09 0.00 0.82 0.00 0.00 66.70 67.38 2pmp h VAL 48 Cb 0.22 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 2pmp h VAL 48 CO -0.01 0.09 -0.44 0.44 0.02 0.00 0.00 177.57 177.68 2pmp h ASP 49 N 0.50 0.00 -0.17 0.57 3.32 -1.36 -0.81 116.42 118.48 2pmp h ASP 49 Ca 0.23 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.24 2pmp h ASP 49 Cb 0.15 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 2pmp h ASP 49 CO -0.17 0.44 -0.06 0.00 -1.72 0.00 0.00 179.24 177.72 2pmp h ALA 50 N 1.56 0.24 0.60 3.45 0.00 -0.87 -0.95 119.26 123.29 2pmp h ALA 50 Ca -0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2pmp h ALA 50 Cb 0.79 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2pmp h ALA 50 CO 0.06 0.03 -0.31 0.82 0.00 0.00 0.00 179.25 179.85 2pmp h ILE 51 N 0.04 0.36 -0.94 0.00 2.04 -1.18 0.58 117.51 118.42 2pmp h ILE 51 Ca 0.04 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.03 2pmp h ILE 51 Cb 0.52 0.36 -0.09 0.00 -0.74 0.00 0.00 36.82 36.88 2pmp h ILE 51 CO 0.02 0.00 0.56 -0.07 0.00 0.00 0.00 178.15 178.66 2pmp h LEU 52 N -0.84 0.79 -0.26 1.44 4.07 -1.22 -2.27 115.31 117.01 2pmp h LEU 52 Ca -0.08 0.06 -0.21 0.00 0.08 0.00 0.00 57.88 57.73 2pmp h LEU 52 Cb 0.66 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.31 2pmp h LEU 52 CO 0.11 0.40 -0.83 1.23 -1.08 0.00 0.00 178.44 178.27 2pmp h GLY 53 N 0.86 0.56 1.05 0.83 0.00 -0.98 -0.62 103.07 104.78 2pmp h GLY 53 Ca 0.48 -0.86 0.04 0.00 0.00 0.00 0.00 47.33 46.99 2pmp h GLY 53 CO -0.29 0.76 0.53 0.00 0.00 0.00 0.00 176.54 177.54 2pmp h ALA 54 N 0.76 1.55 0.00 3.60 0.00 -0.53 -3.04 119.26 121.60 2pmp h ALA 54 Ca -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2pmp h ALA 54 Cb 1.44 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2pmp h ALA 54 CO 0.15 0.36 -0.52 -0.07 0.00 0.00 0.00 179.25 179.17 2pmp h LEU 55 N 0.95 0.00 0.00 0.00 3.38 -1.29 -3.42 115.31 114.94 2pmp h LEU 55 Ca 0.33 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2pmp h LEU 55 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2pmp h LEU 55 CO -0.10 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.09 2pmp n GLY 56 N 1.27 0.44 3.93 0.83 0.00 -0.41 -5.06 105.19 106.19 2pmp n GLY 56 Ca 0.03 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.86 2pmp n GLY 56 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pmp s LEU 57 N 0.00 3.41 0.90 0.99 1.43 -0.38 -5.03 118.68 120.00 2pmp s LEU 57 Ca 0.00 0.62 -0.13 0.00 -1.03 0.00 0.00 54.13 53.59 2pmp s LEU 57 Cb 0.00 -3.48 0.06 0.00 0.03 0.00 0.00 46.19 42.80 2pmp s LEU 57 CO 0.00 -0.89 0.69 -2.65 0.23 0.00 0.00 176.35 173.73 2pmp n PRO 58 N -2.39 -0.19 -2.21 1.29 -0.02 -1.26 -4.64 135.00 125.58 2pmp n PRO 58 Ca 0.03 -0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.24 2pmp n PRO 58 Cb 0.57 -2.04 0.14 0.00 -0.02 0.00 0.00 33.50 32.14 2pmp n PRO 58 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 2pmp s ASP 59 N -2.10 3.87 0.32 2.55 1.47 -1.26 -4.63 116.67 116.89 2pmp s ASP 59 Ca 0.62 0.09 0.05 0.00 1.18 0.00 0.00 52.55 54.49 2pmp s ASP 59 Cb -0.24 -0.36 0.68 0.00 -0.34 0.00 0.00 42.92 42.65 2pmp s ASP 59 CO 0.62 -2.21 1.85 -0.29 0.68 0.00 0.00 175.17 175.82 2pmp h ILE 60 N -1.06 0.88 0.00 2.11 2.10 -1.93 -0.27 117.51 119.34 2pmp h ILE 60 Ca -0.42 -0.29 -0.11 0.00 1.08 0.00 0.00 64.86 65.12 2pmp h ILE 60 Cb 1.26 -0.05 -0.02 0.00 -1.09 0.00 0.00 36.82 36.92 2pmp h ILE 60 CO 0.43 0.16 -0.53 1.23 -1.08 0.00 0.00 178.15 178.35 2pmp h GLY 61 N 0.86 0.00 0.48 8.18 0.00 -1.93 -0.38 103.07 110.28 2pmp h GLY 61 Ca 0.48 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.68 2pmp h GLY 61 CO -0.24 0.00 -0.56 1.46 0.00 0.00 0.00 176.54 177.20 2pmp h GLN 62 N 0.00 0.21 -0.37 4.80 4.20 -1.52 -3.15 115.11 119.27 2pmp h GLN 62 Ca -0.01 -0.36 -0.13 0.00 0.06 0.00 0.00 58.65 58.21 2pmp h GLN 62 Cb 1.01 0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.91 2pmp h GLN 62 CO 0.07 1.17 -0.29 0.82 -0.67 0.00 0.00 178.83 179.93 2pmp h ILE 63 N -0.56 1.28 -2.26 2.54 2.04 -1.17 -3.38 117.51 116.01 2pmp h ILE 63 Ca -0.10 -1.46 -0.59 0.00 1.00 0.00 0.00 64.86 63.72 2pmp h ILE 63 Cb 1.44 1.38 -0.42 0.00 -0.74 0.00 0.00 36.82 38.49 2pmp h ILE 63 CO 0.11 0.48 -0.65 0.49 0.00 0.00 0.00 178.15 178.58 2pmp n PHE 64 N -4.16 3.82 -1.45 1.37 3.72 -0.15 -5.09 117.46 115.51 2pmp n PHE 64 Ca -0.02 -4.02 -0.29 0.00 -0.05 0.00 0.00 57.45 53.06 2pmp n PHE 64 Cb 0.49 -0.50 0.13 0.00 -0.94 0.00 0.00 39.48 38.66 2pmp n PHE 64 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2pmp s PRO 65 N -3.21 1.26 -0.99 -1.08 0.04 -1.19 -4.72 135.00 125.10 2pmp s PRO 65 Ca 0.47 0.46 -0.23 0.00 0.04 0.00 0.00 61.00 61.73 2pmp s PRO 65 Cb 0.25 -1.84 0.03 0.00 0.04 0.00 0.00 34.50 32.99 2pmp s PRO 65 CO -0.11 -2.15 1.52 -0.51 0.04 0.00 0.00 177.00 175.79 2pmp s ASP 66 N -3.85 6.28 0.00 6.66 1.01 -1.26 -4.65 116.67 120.86 2pmp s ASP 66 Ca 0.63 -1.29 0.00 0.00 0.71 0.00 0.00 52.55 52.60 2pmp s ASP 66 Cb -0.16 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.21 2pmp s ASP 66 CO 0.55 -1.71 0.00 -0.24 0.21 0.00 0.00 175.17 173.97 2pmp n SER 67 N 9.70 0.00 -4.62 0.27 2.88 -1.26 -5.13 113.62 115.47 2pmp n SER 67 Ca 0.33 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.44 2pmp n SER 67 Cb 0.50 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.94 2pmp n SER 67 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2pmp s ASP 68 N 0.00 6.08 -0.04 -3.46 1.11 -1.26 -4.74 116.67 114.36 2pmp s ASP 68 Ca 0.00 1.58 -0.11 0.00 0.18 0.00 0.00 52.55 54.20 2pmp s ASP 68 Cb 0.00 -2.53 -0.06 0.00 1.07 0.00 0.00 42.92 41.40 2pmp s ASP 68 CO 0.00 -1.51 0.52 -0.65 1.18 0.00 0.00 175.17 174.71 2pmp h PRO 69 N 12.08 -0.39 0.00 8.23 0.11 -1.99 -3.48 132.00 146.57 2pmp h PRO 69 Ca -0.36 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2pmp h PRO 69 Cb 1.17 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2pmp h PRO 69 CO 1.00 -0.26 -0.07 1.63 -0.21 0.00 0.00 178.00 180.09 2pmp n LYS 70 N -4.59 0.00 0.00 1.05 5.02 -1.26 -5.14 118.16 113.24 2pmp n LYS 70 Ca -0.05 -0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.03 2pmp n LYS 70 Cb 0.16 -0.13 0.00 0.00 -0.02 0.00 0.00 35.03 35.04 2pmp n LYS 70 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2pmp n TRP 71 N 0.00 0.00 0.00 2.13 7.02 -1.26 -4.79 117.44 120.54 2pmp n TRP 71 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2pmp n TRP 71 Cb 0.53 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.42 2pmp n TRP 71 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 2pmp n LYS 72 N 0.00 0.00 -0.81 -0.99 5.02 -1.26 -4.39 118.16 115.73 2pmp n LYS 72 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 2pmp n LYS 72 Cb 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 35.03 35.18 2pmp n LYS 72 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2pmp n GLY 73 N 0.00 4.29 3.73 0.72 0.00 -1.26 -4.72 105.19 107.95 2pmp n GLY 73 Ca 0.00 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 2pmp n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pmp s ALA 74 N -2.57 3.57 0.60 4.61 0.00 -1.26 -5.01 121.76 121.69 2pmp s ALA 74 Ca 0.37 1.14 -0.20 0.00 0.00 0.00 0.00 51.96 53.27 2pmp s ALA 74 Cb 0.37 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.94 2pmp s ALA 74 CO -0.09 -0.59 1.27 0.00 0.00 0.00 0.00 175.76 176.35 2pmp n ALA 75 N 3.24 1.18 0.29 0.00 0.00 -1.26 -4.57 120.51 119.40 2pmp n ALA 75 Ca 0.09 0.06 0.17 0.00 0.00 0.00 0.00 53.44 53.76 2pmp n ALA 75 Cb 0.42 -2.30 0.85 0.00 0.00 0.00 0.00 19.45 18.42 2pmp n ALA 75 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2pmp h SER 76 N 0.91 0.00 -0.91 0.00 0.02 -1.97 -0.76 113.55 110.84 2pmp h SER 76 Ca -0.50 0.00 0.17 0.00 -0.84 0.00 0.00 61.79 60.61 2pmp h SER 76 Cb 1.33 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.77 2pmp h SER 76 CO 0.54 0.05 0.49 0.77 -1.14 0.00 0.00 176.83 177.54 2pmp h SER 77 N 0.00 0.60 -0.97 3.07 4.64 -1.98 -1.71 113.55 117.20 2pmp h SER 77 Ca -0.00 0.10 0.08 0.00 -0.47 0.00 0.00 61.79 61.50 2pmp h SER 77 Cb 0.31 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.33 2pmp h SER 77 CO 0.01 0.22 0.62 0.58 -0.87 0.00 0.00 176.83 177.38 2pmp h VAL 78 N 0.65 1.03 -0.13 0.95 2.07 -1.49 -0.79 116.25 118.54 2pmp h VAL 78 Ca 0.51 -0.37 -0.20 0.00 0.82 0.00 0.00 66.70 67.47 2pmp h VAL 78 Cb 0.77 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 2pmp h VAL 78 CO -0.39 0.20 -0.71 -0.26 0.02 0.00 0.00 177.57 176.43 2pmp h PHE 79 N 1.08 0.79 -0.52 1.57 0.04 -1.46 -2.34 116.94 116.11 2pmp h PHE 79 Ca 0.44 -0.34 -0.01 0.00 2.80 0.00 0.00 57.97 60.86 2pmp h PHE 79 Cb 0.26 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.26 2pmp h PHE 79 CO -0.01 1.12 0.27 0.82 -0.60 0.00 0.00 178.31 179.92 2pmp h ILE 80 N 0.42 1.18 -0.35 -0.55 1.08 -0.89 -1.66 117.51 116.74 2pmp h ILE 80 Ca -0.03 -0.49 -0.09 0.00 -0.39 0.00 0.00 64.86 63.86 2pmp h ILE 80 Cb 1.31 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 35.61 2pmp h ILE 80 CO 0.14 0.20 -0.14 0.11 -0.69 0.00 0.00 178.15 177.76 2pmp h LYS 81 N 0.69 0.72 -0.64 2.37 1.79 -1.16 -1.64 116.57 118.71 2pmp h LYS 81 Ca 0.18 -0.30 -0.03 0.00 -2.18 0.00 0.00 60.65 58.32 2pmp h LYS 81 Cb 0.07 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.67 2pmp h LYS 81 CO -0.03 0.90 0.28 1.49 -1.08 0.00 0.00 179.45 181.02 2pmp h GLU 82 N 0.51 0.92 -0.47 3.15 4.57 -1.41 -1.93 114.58 119.91 2pmp h GLU 82 Ca 0.08 -0.13 -0.08 0.00 -1.18 0.00 0.00 59.36 58.05 2pmp h GLU 82 Cb 0.67 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.08 2pmp h GLU 82 CO 0.05 0.73 -0.02 0.00 -1.18 0.00 0.00 179.01 178.58 2pmp h ALA 83 N 1.40 0.63 0.00 2.92 0.00 -1.06 -2.17 119.26 120.98 2pmp h ALA 83 Ca 0.22 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 2pmp h ALA 83 Cb 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2pmp h ALA 83 CO -0.03 0.45 -0.40 -0.39 0.00 0.00 0.00 179.25 178.88 2pmp h VAL 84 N 0.69 1.17 -0.28 0.00 -1.51 -1.15 -1.59 116.25 113.59 2pmp h VAL 84 Ca 0.13 -1.44 -0.04 0.00 -1.23 0.00 0.00 66.70 64.12 2pmp h VAL 84 Cb 0.53 1.80 -0.01 0.00 -2.13 0.00 0.00 31.29 31.49 2pmp h VAL 84 CO 0.03 0.40 0.01 -0.09 -1.23 0.00 0.00 177.57 176.69 2pmp h ARG 85 N 0.00 0.49 -0.07 5.19 2.43 -1.25 -1.05 114.38 120.12 2pmp h ARG 85 Ca -0.00 -0.15 -0.10 0.00 -0.81 0.00 0.00 59.98 58.92 2pmp h ARG 85 Cb 0.77 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 2pmp h ARG 85 CO 0.05 0.63 -0.41 -0.07 -1.51 0.00 0.00 179.97 178.67 2pmp h LEU 86 N 0.29 0.16 -0.04 3.80 3.38 -1.24 -0.92 115.31 120.74 2pmp h LEU 86 Ca 0.08 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2pmp h LEU 86 Cb 0.40 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2pmp h LEU 86 CO 0.01 0.55 -0.01 -0.03 0.09 0.00 0.00 178.44 179.06 2pmp h MET 87 N 0.13 0.07 -0.22 1.13 4.05 -1.24 -2.62 114.93 116.24 2pmp h MET 87 Ca 0.01 -0.03 0.03 0.00 -0.28 0.00 0.00 59.70 59.44 2pmp h MET 87 Cb 0.78 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.54 2pmp h MET 87 CO 0.06 0.41 0.02 0.22 0.23 0.00 0.00 176.91 177.85 2pmp h ASP 88 N -0.27 -0.04 0.70 1.39 3.58 -0.96 -1.82 116.42 119.00 2pmp h ASP 88 Ca 0.01 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2pmp h ASP 88 Cb 0.38 0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.50 2pmp h ASP 88 CO 0.00 0.01 0.00 1.05 -2.88 0.00 0.00 179.24 177.42 2pmp h GLU 89 N 0.09 0.00 0.00 0.28 4.11 -1.21 -0.77 114.58 117.09 2pmp h GLU 89 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.53 2pmp h GLU 89 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2pmp h GLU 89 CO -0.16 0.00 -0.26 0.00 0.07 0.00 0.00 179.01 178.67 2pmp n ALA 90 N -2.02 2.59 -0.22 1.06 0.00 -0.83 -4.94 120.51 116.16 2pmp n ALA 90 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2pmp n ALA 90 Cb 0.23 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.34 2pmp n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pmp n GLY 91 N 1.35 1.82 3.31 0.00 0.00 -0.29 -5.04 105.19 106.33 2pmp n GLY 91 Ca 0.05 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.77 2pmp n GLY 91 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2pmp s TYR 92 N -2.00 1.69 0.29 1.61 2.02 -0.75 -1.05 117.35 119.16 2pmp s TYR 92 Ca 0.00 -0.52 0.03 0.00 -0.37 0.00 0.00 57.07 56.21 2pmp s TYR 92 Cb 0.00 -0.84 -0.06 0.00 -0.40 0.00 0.00 41.96 40.66 2pmp s TYR 92 CO 0.00 0.29 0.08 -1.83 -1.57 0.00 0.00 175.55 172.52 2pmp s GLU 93 N -2.97 1.53 -0.13 -0.62 -1.05 0.16 -3.72 118.70 111.90 2pmp s GLU 93 Ca 0.16 -1.84 -0.29 0.00 -0.15 0.00 0.00 54.97 52.84 2pmp s GLU 93 Cb -0.04 -0.57 -0.01 0.00 -0.44 0.00 0.00 34.13 33.06 2pmp s GLU 93 CO 0.06 -0.24 1.13 0.42 0.95 0.00 0.00 175.26 177.57 2pmp s ILE 94 N -3.52 4.50 -0.04 1.83 1.01 -1.26 -0.03 121.20 123.68 2pmp s ILE 94 Ca 0.37 1.80 -0.01 0.00 0.00 0.00 0.00 60.65 62.82 2pmp s ILE 94 Cb 0.08 -4.16 -0.00 0.00 0.01 0.00 0.00 42.46 38.39 2pmp s ILE 94 CO 0.15 -0.07 0.05 1.23 0.00 0.00 0.00 174.94 176.29 2pmp h GLY 95 N 8.73 -0.02 -2.65 6.18 0.00 -1.31 -3.44 103.07 110.56 2pmp h GLY 95 Ca -0.28 0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 2pmp h GLY 95 CO 0.91 -0.01 0.05 0.54 0.00 0.00 0.00 176.54 178.04 2pmp s ASN 96 N -4.02 -0.29 -0.04 0.19 4.22 -0.97 -4.87 114.94 109.17 2pmp s ASN 96 Ca -0.00 -0.44 0.01 0.00 -2.14 0.00 0.00 52.86 50.29 2pmp s ASN 96 Cb 0.00 0.58 0.02 0.00 1.28 0.00 0.00 41.25 43.13 2pmp s ASN 96 CO 0.01 -1.05 -0.05 -0.22 -2.04 0.00 0.00 177.10 173.75 2pmp s LEU 97 N -2.86 1.42 -0.20 3.54 0.20 0.06 -1.31 118.68 119.54 2pmp s LEU 97 Ca 0.08 -0.14 -0.01 0.00 0.69 0.00 0.00 54.13 54.74 2pmp s LEU 97 Cb -0.01 -0.47 0.06 0.00 -0.43 0.00 0.00 46.19 45.33 2pmp s LEU 97 CO -0.04 -0.03 -0.00 -0.62 -0.29 0.00 0.00 176.35 175.37 2pmp s ASP 98 N 0.78 3.14 -0.08 3.68 2.15 -0.06 -0.77 116.67 125.52 2pmp s ASP 98 Ca -0.11 -0.89 -0.03 0.00 0.43 0.00 0.00 52.55 51.95 2pmp s ASP 98 Cb -0.14 -0.80 -0.04 0.00 -0.30 0.00 0.00 42.92 41.65 2pmp s ASP 98 CO 0.01 -0.27 0.05 0.00 -0.17 0.00 0.00 175.17 174.78 2pmp s ALA 99 N 1.70 3.47 -0.17 3.66 0.00 -0.05 -1.33 121.76 129.04 2pmp s ALA 99 Ca -0.02 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.17 2pmp s ALA 99 Cb -0.17 -1.60 0.02 0.00 0.00 0.00 0.00 23.12 21.36 2pmp s ALA 99 CO -0.07 0.61 -0.18 0.99 0.00 0.00 0.00 175.76 177.11 2pmp s THR 100 N -0.97 1.90 -0.18 0.00 2.01 0.17 -1.20 115.64 117.37 2pmp s THR 100 Ca 0.15 -0.85 -0.11 0.00 0.31 0.00 0.00 61.69 61.19 2pmp s THR 100 Cb -0.12 -1.74 -0.05 0.00 0.01 0.00 0.00 72.50 70.61 2pmp s THR 100 CO 0.05 0.50 0.18 -0.22 -0.69 0.00 0.00 174.62 174.44 2pmp s LEU 101 N 1.35 4.24 -0.27 4.42 2.96 0.07 -0.43 118.68 131.03 2pmp s LEU 101 Ca 0.05 0.35 -0.05 0.00 -0.22 0.00 0.00 54.13 54.26 2pmp s LEU 101 Cb -0.13 -2.18 0.01 0.00 0.50 0.00 0.00 46.19 44.39 2pmp s LEU 101 CO -0.12 0.18 0.02 -0.63 -1.32 0.00 0.00 176.35 174.47 2pmp s ILE 102 N 0.25 3.56 -0.26 6.68 1.01 0.43 -0.44 121.20 132.43 2pmp s ILE 102 Ca 0.11 -0.73 -0.10 0.00 0.00 0.00 0.00 60.65 59.93 2pmp s ILE 102 Cb -0.12 -2.79 0.11 0.00 0.01 0.00 0.00 42.46 39.67 2pmp s ILE 102 CO 0.01 0.18 0.58 -0.22 0.00 0.00 0.00 174.94 175.49 2pmp s LEU 103 N 1.45 -0.91 0.10 2.97 2.96 0.20 -1.98 118.68 123.46 2pmp s LEU 103 Ca 0.03 1.37 -0.17 0.00 -0.22 0.00 0.00 54.13 55.14 2pmp s LEU 103 Cb -0.16 2.01 -0.06 0.00 0.50 0.00 0.00 46.19 48.47 2pmp s LEU 103 CO -0.00 -0.22 1.50 -0.61 -1.32 0.00 0.00 176.35 175.69 2pmp h GLN 104 N 7.82 0.58 -2.36 1.98 5.75 -1.79 -3.32 115.11 123.77 2pmp h GLN 104 Ca -0.21 -0.22 -0.07 0.00 -0.15 0.00 0.00 58.65 58.00 2pmp h GLN 104 Cb 1.13 -0.04 -0.18 0.00 1.07 0.00 0.00 27.48 29.46 2pmp h GLN 104 CO 0.13 0.77 0.07 1.03 -2.65 0.00 0.00 178.83 178.18 2pmp s ARG 105 N -4.80 0.99 0.59 1.69 0.52 -1.26 -4.82 118.95 111.86 2pmp s ARG 105 Ca -0.13 0.06 -0.08 0.00 -0.52 0.00 0.00 55.73 55.07 2pmp s ARG 105 Cb 0.08 0.46 0.13 0.00 0.52 0.00 0.00 34.95 36.14 2pmp s ARG 105 CO 0.78 -0.32 0.81 -0.35 0.02 0.00 0.00 175.30 176.24 2pmp n PRO 106 N 0.85 -0.55 -2.16 3.54 -0.04 -1.26 -5.04 135.00 130.34 2pmp n PRO 106 Ca -0.19 -1.50 -0.42 0.00 -0.04 0.00 0.00 63.50 61.35 2pmp n PRO 106 Cb 0.58 -0.76 -0.03 0.00 -0.04 0.00 0.00 33.50 33.25 2pmp n PRO 106 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2pmp s LYS 107 N -4.69 4.27 0.11 0.54 2.20 -1.26 -4.95 119.74 115.97 2pmp s LYS 107 Ca 0.48 2.05 0.16 0.00 -0.36 0.00 0.00 55.97 58.30 2pmp s LYS 107 Cb -0.02 -3.52 -0.09 0.00 -1.51 0.00 0.00 37.83 32.69 2pmp s LYS 107 CO 0.33 -0.58 0.97 0.82 -0.36 0.00 0.00 175.35 176.53 2pmp h ILE 108 N 4.78 0.60 -0.88 5.43 1.08 -1.98 -3.42 117.51 123.12 2pmp h ILE 108 Ca -0.39 -2.07 0.12 0.00 -0.39 0.00 0.00 64.86 62.13 2pmp h ILE 108 Cb 1.19 2.13 -0.08 0.00 -3.07 0.00 0.00 36.82 36.99 2pmp h ILE 108 CO 0.90 0.34 0.51 0.77 -0.69 0.00 0.00 178.15 179.98 2pmp h SER 109 N 0.00 0.69 0.11 1.72 4.64 -1.99 0.23 113.55 118.95 2pmp h SER 109 Ca -0.12 0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2pmp h SER 109 Cb 1.54 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.57 2pmp h SER 109 CO 0.05 0.35 -0.02 -0.65 -0.87 0.00 0.00 176.83 175.70 2pmp h PRO 110 N 0.78 0.00 -0.03 4.77 0.11 -2.02 -2.32 132.00 133.29 2pmp h PRO 110 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 2pmp h PRO 110 Cb 0.52 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.63 2pmp h PRO 110 CO -0.30 0.02 -0.08 0.72 -0.21 0.00 0.00 178.00 178.15 2pmp n HIS 111 N -3.43 0.00 -0.03 0.65 8.25 0.03 -4.71 115.22 115.98 2pmp n HIS 111 Ca -0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.33 2pmp n HIS 111 Cb 0.11 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.18 2pmp n HIS 111 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2pmp h LYS 112 N 4.07 0.19 -0.37 -0.41 3.64 -0.98 -0.22 116.57 122.49 2pmp h LYS 112 Ca 0.00 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.24 2pmp h LYS 112 Cb 0.91 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 2pmp h LYS 112 CO 0.00 0.13 -0.29 0.93 -2.27 0.00 0.00 179.45 177.95 2pmp h GLU 113 N 0.20 0.79 -0.96 1.90 4.39 -1.84 0.36 114.58 119.42 2pmp h GLU 113 Ca 0.06 -0.35 0.05 0.00 0.34 0.00 0.00 59.36 59.46 2pmp h GLU 113 Cb -0.01 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.56 2pmp h GLU 113 CO -0.02 0.98 0.62 1.15 -1.16 0.00 0.00 179.01 180.57 2pmp h THR 114 N 0.67 1.11 -0.08 1.13 2.02 -1.77 -0.88 112.91 115.11 2pmp h THR 114 Ca 0.08 -0.40 -0.03 0.00 0.77 0.00 0.00 66.41 66.84 2pmp h THR 114 Cb 0.82 -0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 67.09 2pmp h THR 114 CO 0.07 0.21 -0.06 0.40 0.37 0.00 0.00 175.52 176.51 2pmp h ILE 115 N 1.15 1.35 -0.63 3.11 2.04 -0.38 -2.50 117.51 121.65 2pmp h ILE 115 Ca 0.40 -1.17 0.03 0.00 1.00 0.00 0.00 64.86 65.12 2pmp h ILE 115 Cb 0.10 1.96 -0.04 0.00 -0.74 0.00 0.00 36.82 38.10 2pmp h ILE 115 CO -0.15 0.33 0.39 -0.09 0.00 0.00 0.00 178.15 178.62 2pmp h ARG 116 N -0.22 0.74 -0.68 2.37 2.43 -0.78 -0.15 114.38 118.09 2pmp h ARG 116 Ca 0.01 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.07 2pmp h ARG 116 Cb 0.55 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 2pmp h ARG 116 CO 0.02 0.49 0.16 0.77 -1.51 0.00 0.00 179.97 179.90 2pmp h SER 117 N 0.76 1.04 -0.25 -3.80 0.02 -1.17 -0.11 113.55 110.03 2pmp h SER 117 Ca 0.26 -0.24 -0.07 0.00 -0.84 0.00 0.00 61.79 60.90 2pmp h SER 117 Cb 0.03 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 2pmp h SER 117 CO -0.11 1.01 -0.12 -1.13 -1.14 0.00 0.00 176.83 175.34 2pmp h ASN 118 N 1.03 0.54 -0.72 3.07 -1.24 -0.96 -0.01 115.58 117.28 2pmp h ASN 118 Ca 0.21 -0.41 0.00 0.00 0.71 0.00 0.00 56.30 56.82 2pmp h ASN 118 Cb 0.37 -0.15 -0.04 0.00 0.73 0.00 0.00 38.32 39.24 2pmp h ASN 118 CO 0.00 0.83 0.46 0.25 -1.29 0.00 0.00 177.43 177.68 2pmp h LEU 119 N 0.25 0.85 -0.48 0.34 5.85 -0.96 -1.63 115.31 119.54 2pmp h LEU 119 Ca 0.06 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2pmp h LEU 119 Cb 0.62 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 2pmp h LEU 119 CO 0.04 0.63 0.31 0.28 -0.34 0.00 0.00 178.44 179.36 2pmp h SER 120 N 0.98 0.56 -0.60 1.25 0.02 -0.94 -0.99 113.55 113.82 2pmp h SER 120 Ca 0.26 -0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.23 2pmp h SER 120 Cb -0.08 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.28 2pmp h SER 120 CO -0.05 0.42 0.35 0.50 -1.14 0.00 0.00 176.83 176.90 2pmp h LYS 121 N 0.65 0.65 -0.08 3.45 3.64 -0.69 -0.46 116.57 123.71 2pmp h LYS 121 Ca 0.17 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.36 2pmp h LYS 121 Cb -0.06 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 2pmp h LYS 121 CO -0.04 0.43 -0.62 -0.07 -2.27 0.00 0.00 179.45 176.88 2pmp h LEU 122 N 0.66 0.35 -0.43 5.20 3.38 -1.07 -3.07 115.31 120.34 2pmp h LEU 122 Ca 0.26 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 2pmp h LEU 122 Cb 0.10 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2pmp h LEU 122 CO -0.14 0.88 -0.28 -0.07 0.09 0.00 0.00 178.44 178.92 2pmp h LEU 123 N 0.22 0.00 -0.51 1.67 3.38 -0.90 -3.42 115.31 115.75 2pmp h LEU 123 Ca -0.01 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 2pmp h LEU 123 Cb 1.14 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.93 2pmp h LEU 123 CO 0.10 0.28 -0.24 0.61 0.09 0.00 0.00 178.44 179.28 2pmp n GLY 124 N 0.80 0.34 3.47 0.83 0.00 -0.24 -4.98 105.19 105.40 2pmp n GLY 124 Ca 0.02 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.42 2pmp n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pmp s ALA 125 N -2.96 2.60 0.22 4.61 0.00 -0.86 -5.05 121.76 120.32 2pmp s ALA 125 Ca 0.17 -1.94 -0.30 0.00 0.00 0.00 0.00 51.96 49.89 2pmp s ALA 125 Cb -0.07 -0.01 -0.08 0.00 0.00 0.00 0.00 23.12 22.95 2pmp s ALA 125 CO 0.21 0.06 0.97 0.34 0.00 0.00 0.00 175.76 177.34 2pmp s ASP 126 N -3.50 7.55 0.65 0.00 2.15 -1.26 -4.53 116.67 117.74 2pmp s ASP 126 Ca 0.30 1.97 0.35 0.00 0.43 0.00 0.00 52.55 55.60 2pmp s ASP 126 Cb 0.01 -2.61 1.93 0.00 -0.30 0.00 0.00 42.92 41.96 2pmp s ASP 126 CO 0.13 0.06 2.12 -0.65 -0.17 0.00 0.00 175.17 176.67 2pmp h PRO 127 N 4.41 0.00 0.00 4.34 0.11 -1.90 -1.04 132.00 137.92 2pmp h PRO 127 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2pmp h PRO 127 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2pmp h PRO 127 CO 0.69 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.35 2pmp n SER 128 N -3.14 0.00 -0.19 -2.05 3.41 -1.26 -2.98 113.62 107.41 2pmp n SER 128 Ca -0.02 0.34 0.02 0.00 -0.26 0.00 0.00 58.87 58.96 2pmp n SER 128 Cb 0.26 -0.43 0.02 0.00 -0.26 0.00 0.00 64.21 63.80 2pmp n SER 128 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2pmp n VAL 129 N -1.43 0.05 -3.91 -3.33 0.24 -0.40 -4.97 118.33 104.57 2pmp n VAL 129 Ca 0.06 -0.52 -0.35 0.00 -2.04 0.00 0.00 64.34 61.49 2pmp n VAL 129 Cb 0.20 1.07 -0.14 0.00 -1.47 0.00 0.00 33.84 33.50 2pmp n VAL 129 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2pmp s VAL 130 N -0.42 3.10 0.10 3.34 1.01 -1.16 -0.76 120.40 125.61 2pmp s VAL 130 Ca 0.06 -1.03 0.08 0.00 0.00 0.00 0.00 61.98 61.08 2pmp s VAL 130 Cb 0.04 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 2pmp s VAL 130 CO 0.06 0.12 -0.20 0.21 0.00 0.00 0.00 175.10 175.28 2pmp s ASN 131 N 1.34 2.43 -0.02 3.32 3.84 0.05 -4.90 114.94 121.00 2pmp s ASN 131 Ca -0.00 -0.68 -0.01 0.00 0.21 0.00 0.00 52.86 52.38 2pmp s ASN 131 Cb -0.17 -0.13 0.01 0.00 -0.55 0.00 0.00 41.25 40.41 2pmp s ASN 131 CO -0.03 0.04 0.05 -0.22 -2.79 0.00 0.00 177.10 174.16 2pmp s LEU 132 N -1.88 1.52 0.26 3.21 0.20 -1.26 -0.88 118.68 119.85 2pmp s LEU 132 Ca 0.05 0.10 0.03 0.00 0.69 0.00 0.00 54.13 55.01 2pmp s LEU 132 Cb -0.10 0.13 -0.05 0.00 -0.43 0.00 0.00 46.19 45.73 2pmp s LEU 132 CO 0.04 -0.06 0.02 -1.59 -0.29 0.00 0.00 176.35 174.47 2pmp s LYS 133 N 0.41 1.43 0.08 1.98 -2.85 -0.34 -4.96 119.74 115.49 2pmp s LYS 133 Ca -0.03 -1.75 0.04 0.00 -1.00 0.00 0.00 55.97 53.23 2pmp s LYS 133 Cb -0.05 -0.66 -0.03 0.00 -2.06 0.00 0.00 37.83 35.03 2pmp s LYS 133 CO -0.01 -0.13 -0.12 0.00 0.10 0.00 0.00 175.35 175.19 2pmp s ALA 134 N -3.41 1.07 -0.03 0.59 0.00 -1.26 -0.75 121.76 117.98 2pmp s ALA 134 Ca 0.31 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 51.18 2pmp s ALA 134 Cb 0.07 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.17 2pmp s ALA 134 CO 0.11 0.05 0.10 0.21 0.00 0.00 0.00 175.76 176.23 2pmp s LYS 135 N -2.17 0.21 1.05 0.00 2.47 0.42 -4.93 119.74 116.79 2pmp s LYS 135 Ca 0.00 -0.04 -0.17 0.00 -1.56 0.00 0.00 55.97 54.20 2pmp s LYS 135 Cb -0.07 0.09 0.24 0.00 -1.46 0.00 0.00 37.83 36.63 2pmp s LYS 135 CO 0.01 -0.04 1.28 0.95 0.16 0.00 0.00 175.35 177.71 2pmp s THR 136 N -0.39 1.88 -0.16 3.43 -4.23 -1.25 -0.63 115.64 114.29 2pmp s THR 136 Ca -0.05 0.00 0.15 0.00 -1.18 0.00 0.00 61.69 60.62 2pmp s THR 136 Cb -0.03 -2.86 0.43 0.00 1.34 0.00 0.00 72.50 71.38 2pmp s THR 136 CO 0.00 0.00 1.20 1.57 -0.54 0.00 0.00 174.62 176.86 2pmp n HIS 137 N -4.10 0.18 -3.47 3.99 -0.00 -1.26 -4.72 115.22 105.84 2pmp n HIS 137 Ca 0.16 -1.28 -0.25 0.00 0.46 0.00 0.00 57.72 56.80 2pmp n HIS 137 Cb 0.59 -0.23 0.01 0.00 -0.12 0.00 0.00 29.99 30.25 2pmp n HIS 137 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2pmp n GLU 138 N -0.64 -4.17 -1.14 1.57 -0.58 -1.26 -2.10 120.64 112.31 2pmp n GLU 138 Ca 0.17 0.58 -0.05 0.00 -0.42 0.00 0.00 57.16 57.43 2pmp n GLU 138 Cb 0.83 -5.36 -0.02 0.00 -0.57 0.00 0.00 31.44 26.32 2pmp n GLU 138 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2pmp n LYS 139 N -4.04 -1.50 -4.24 3.49 5.02 -1.26 -4.98 118.16 110.66 2pmp n LYS 139 Ca -0.01 0.61 -0.29 0.00 -2.02 0.00 0.00 58.31 56.60 2pmp n LYS 139 Cb 0.55 -4.83 -0.10 0.00 -0.02 0.00 0.00 35.03 30.63 2pmp n LYS 139 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2pmp s VAL 140 N -1.61 3.36 0.16 -0.18 -7.23 -0.89 -4.38 120.40 109.63 2pmp s VAL 140 Ca 0.00 -1.36 0.00 0.00 -1.81 0.00 0.00 61.98 58.81 2pmp s VAL 140 Cb 0.00 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 34.34 2pmp s VAL 140 CO 0.00 0.04 0.00 0.47 -0.31 0.00 0.00 175.10 175.30 2pmp n ASP 141 N 0.49 -7.16 -0.14 4.85 8.00 -1.26 -1.22 116.55 120.11 2pmp n ASP 141 Ca -0.13 0.73 0.01 0.00 0.71 0.00 0.00 54.79 56.12 2pmp n ASP 141 Cb 0.53 -2.05 0.30 0.00 -0.02 0.00 0.00 41.12 39.88 2pmp n ASP 141 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2pmp h SER 142 N -0.63 0.73 -0.20 -2.24 4.64 -1.96 -1.48 113.55 112.42 2pmp h SER 142 Ca 0.01 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.25 2pmp h SER 142 Cb 0.62 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 2pmp h SER 142 CO 0.00 0.54 -0.09 -0.07 -0.87 0.00 0.00 176.83 176.35 2pmp h LEU 143 N 0.86 0.42 -1.48 5.97 3.38 -1.80 0.30 115.31 122.96 2pmp h LEU 143 Ca 0.23 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2pmp h LEU 143 Cb -0.07 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2pmp h LEU 143 CO -0.05 0.73 -0.09 1.23 0.09 0.00 0.00 178.44 180.36 2pmp h GLY 144 N 0.10 0.25 -0.12 0.83 0.00 -0.96 -2.41 103.07 100.76 2pmp h GLY 144 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2pmp h GLY 144 CO 0.03 0.13 0.00 1.18 0.00 0.00 0.00 176.54 177.88 2pmp n GLU 145 N -4.31 1.29 -2.63 4.80 1.02 -0.58 -3.99 120.64 116.23 2pmp n GLU 145 Ca -0.01 -0.44 -0.22 0.00 -0.02 0.00 0.00 57.16 56.48 2pmp n GLU 145 Cb 0.23 -1.26 0.01 0.00 -0.02 0.00 0.00 31.44 30.40 2pmp n GLU 145 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2pmp n ASN 146 N -0.29 -6.02 -0.88 1.62 4.05 -0.89 -4.87 115.26 107.98 2pmp n ASN 146 Ca 0.12 -0.12 0.12 0.00 0.45 0.00 0.00 54.58 55.15 2pmp n ASN 146 Cb 0.15 -4.96 0.17 0.00 1.23 0.00 0.00 39.78 36.37 2pmp n ASN 146 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2pmp n ARG 147 N -3.40 2.22 -3.74 1.20 1.74 0.10 -4.67 116.66 110.11 2pmp n ARG 147 Ca -0.20 -1.77 -0.07 0.00 -0.77 0.00 0.00 57.85 55.04 2pmp n ARG 147 Cb 0.66 -1.46 -0.02 0.00 -1.02 0.00 0.00 32.46 30.62 2pmp n ARG 147 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2pmp s SER 148 N -2.00 -0.29 -0.01 0.55 1.04 -1.16 -1.51 113.70 110.32 2pmp s SER 148 Ca 0.30 -0.42 0.01 0.00 0.48 0.00 0.00 55.95 56.32 2pmp s SER 148 Cb 0.20 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.94 2pmp s SER 148 CO 0.31 -1.11 -0.03 -0.51 0.98 0.00 0.00 173.24 172.87 2pmp s ILE 149 N -3.65 0.29 0.17 -1.02 2.07 -0.15 -4.54 121.20 114.36 2pmp s ILE 149 Ca 0.10 -0.12 0.06 0.00 -1.41 0.00 0.00 60.65 59.28 2pmp s ILE 149 Cb -0.04 -0.27 -0.04 0.00 0.13 0.00 0.00 42.46 42.24 2pmp s ILE 149 CO 0.02 0.10 -0.13 0.00 -1.91 0.00 0.00 174.94 173.02 2pmp s ALA 150 N 0.14 1.71 -0.03 1.50 0.00 -0.84 -0.71 121.76 123.54 2pmp s ALA 150 Ca -0.01 -1.52 -0.02 0.00 0.00 0.00 0.00 51.96 50.41 2pmp s ALA 150 Cb -0.04 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.05 2pmp s ALA 150 CO -0.00 0.02 0.06 0.00 0.00 0.00 0.00 175.76 175.84 2pmp s ALA 151 N -2.92 -0.12 -0.00 0.00 0.00 0.36 -0.43 121.76 118.66 2pmp s ALA 151 Ca 0.18 0.25 0.03 0.00 0.00 0.00 0.00 51.96 52.41 2pmp s ALA 151 Cb -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 2pmp s ALA 151 CO 0.04 -0.06 -0.05 -1.01 0.00 0.00 0.00 175.76 174.68 2pmp s HIS 152 N 0.36 2.93 -0.07 0.00 3.76 0.43 -1.22 115.29 121.46 2pmp s HIS 152 Ca -0.03 -0.01 0.01 0.00 -0.15 0.00 0.00 55.06 54.88 2pmp s HIS 152 Cb -0.04 -1.63 0.02 0.00 1.11 0.00 0.00 32.58 32.04 2pmp s HIS 152 CO -0.01 0.39 -0.08 0.99 -0.85 0.00 0.00 174.74 175.17 2pmp s THR 153 N -1.00 0.90 -0.16 1.30 2.01 0.06 0.43 115.64 119.18 2pmp s THR 153 Ca 0.17 -0.30 -0.07 0.00 0.31 0.00 0.00 61.69 61.80 2pmp s THR 153 Cb -0.11 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.48 2pmp s THR 153 CO 0.08 0.32 0.07 0.68 -0.69 0.00 0.00 174.62 175.07 2pmp s VAL 154 N 1.06 4.84 0.03 3.82 -7.23 -0.44 -0.23 120.40 122.24 2pmp s VAL 154 Ca -0.08 -0.02 0.06 0.00 -1.81 0.00 0.00 61.98 60.13 2pmp s VAL 154 Cb -0.14 -3.15 -0.02 0.00 0.56 0.00 0.00 36.38 33.62 2pmp s VAL 154 CO -0.01 0.50 -0.18 -0.51 -0.31 0.00 0.00 175.10 174.60 2pmp s ILE 155 N 0.03 1.41 -0.26 -0.62 2.07 -0.46 -0.88 121.20 122.50 2pmp s ILE 155 Ca 0.06 -1.02 -0.01 0.00 -1.41 0.00 0.00 60.65 58.28 2pmp s ILE 155 Cb -0.12 -1.22 0.04 0.00 0.13 0.00 0.00 42.46 41.28 2pmp s ILE 155 CO 0.01 0.18 -0.07 -0.22 -1.91 0.00 0.00 174.94 172.93 2pmp s LEU 156 N -0.97 3.32 0.09 8.50 2.96 -0.42 -0.94 118.68 131.22 2pmp s LEU 156 Ca 0.05 -1.04 -0.14 0.00 -0.22 0.00 0.00 54.13 52.79 2pmp s LEU 156 Cb -0.08 -1.64 -0.06 0.00 0.50 0.00 0.00 46.19 44.91 2pmp s LEU 156 CO 0.01 -0.16 0.48 -0.76 -1.32 0.00 0.00 176.35 174.60 2pmp s LEU 157 N 1.27 4.38 -0.09 -0.68 1.43 0.68 -0.89 118.68 124.79 2pmp s LEU 157 Ca -0.02 0.99 0.01 0.00 -1.03 0.00 0.00 54.13 54.08 2pmp s LEU 157 Cb -0.18 -3.03 -0.02 0.00 0.03 0.00 0.00 46.19 42.99 2pmp s LEU 157 CO -0.04 0.18 -0.11 -0.04 0.23 0.00 0.00 176.35 176.56 2pmp s MET 158 N -1.70 2.94 0.24 1.70 -1.94 0.95 -1.50 119.30 120.00 2pmp s MET 158 Ca 0.33 -0.64 -0.31 0.00 -1.71 0.00 0.00 55.69 53.36 2pmp s MET 158 Cb -0.15 -2.56 -0.11 0.00 2.01 0.00 0.00 34.83 34.01 2pmp s MET 158 CO 0.18 0.47 1.65 0.21 -0.01 0.00 0.00 175.02 177.52 2pmp s LYS 159 N -0.31 4.13 0.00 2.03 2.47 -0.25 0.37 119.74 128.18 2pmp s LYS 159 Ca 0.03 2.57 0.00 0.00 -1.56 0.00 0.00 55.97 57.01 2pmp s LYS 159 Cb -0.13 -3.06 0.00 0.00 -1.46 0.00 0.00 37.83 33.18 2pmp s LYS 159 CO 0.03 -0.68 0.44 1.63 0.16 0.00 0.00 175.35 176.92