#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cnp n ALA 2 N 0.00 4.41 -0.73 -5.12 0.00 -1.26 -4.94 120.51 112.87 2cnp n ALA 2 Ca 0.00 -3.71 -0.32 0.00 0.00 0.00 0.00 53.44 49.41 2cnp n ALA 2 Cb 0.00 -3.57 0.15 0.00 0.00 0.00 0.00 19.45 16.03 2cnp n ALA 2 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2cnp n SER 3 N 7.49 -1.56 -0.26 0.00 7.64 -1.26 -4.35 113.62 121.33 2cnp n SER 3 Ca 0.50 0.26 0.03 0.00 1.01 0.00 0.00 58.87 60.68 2cnp n SER 3 Cb 0.41 -1.24 0.12 0.00 -1.01 0.00 0.00 64.21 62.49 2cnp n SER 3 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2cnp h PRO 4 N -1.77 0.03 0.02 1.43 0.11 -1.99 0.15 132.00 129.98 2cnp h PRO 4 Ca -0.46 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.68 2cnp h PRO 4 Cb 1.29 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.36 2cnp h PRO 4 CO 0.37 0.02 -0.19 -0.07 -0.21 0.00 0.00 178.00 177.92 2cnp h LEU 5 N 0.04 -0.55 -0.85 2.35 3.38 -1.99 0.45 115.31 118.13 2cnp h LEU 5 Ca 0.38 0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.43 2cnp h LEU 5 Cb 0.62 0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.56 2cnp h LEU 5 CO -0.73 -0.26 0.55 -0.78 0.09 0.00 0.00 178.44 177.32 2cnp h ASP 6 N -0.31 0.99 0.11 -0.43 3.58 -1.15 0.13 116.42 119.33 2cnp h ASP 6 Ca 0.05 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 2cnp h ASP 6 Cb 0.38 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.18 2cnp h ASP 6 CO -0.17 0.73 -0.05 -0.61 -2.88 0.00 0.00 179.24 176.26 2cnp h GLN 7 N 1.16 -0.14 -0.40 0.28 5.75 -0.65 0.21 115.11 121.32 2cnp h GLN 7 Ca 0.31 0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.82 2cnp h GLN 7 Cb -0.11 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2cnp h GLN 7 CO -0.06 -0.05 0.24 0.00 -2.65 0.00 0.00 178.83 176.30 2cnp h ALA 8 N 0.70 0.51 -0.17 3.38 0.00 -0.36 0.19 119.26 123.50 2cnp h ALA 8 Ca -0.01 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.88 2cnp h ALA 8 Cb 0.15 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 2cnp h ALA 8 CO 0.02 0.01 -0.18 0.82 0.00 0.00 0.00 179.25 179.92 2cnp h ILE 9 N 0.52 0.53 -0.70 0.00 2.04 -0.72 -1.54 117.51 117.64 2cnp h ILE 9 Ca 0.14 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.16 2cnp h ILE 9 Cb 0.01 0.53 -0.12 0.00 -0.74 0.00 0.00 36.82 36.50 2cnp h ILE 9 CO -0.03 0.00 0.01 1.23 0.00 0.00 0.00 178.15 179.37 2cnp h GLY 10 N -0.20 0.78 0.61 5.37 0.00 0.37 0.10 103.07 110.10 2cnp h GLY 10 Ca 0.11 0.09 0.01 0.00 0.00 0.00 0.00 47.33 47.54 2cnp h GLY 10 CO -0.29 -0.25 -0.26 1.41 0.00 0.00 0.00 176.54 177.15 2cnp h LEU 11 N 0.12 -0.73 -0.63 3.11 3.38 -0.07 0.26 115.31 120.75 2cnp h LEU 11 Ca 0.38 0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.45 2cnp h LEU 11 Cb 0.65 0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.62 2cnp h LEU 11 CO -0.60 -0.36 0.40 -0.07 0.09 0.00 0.00 178.44 177.89 2cnp h LEU 12 N -0.50 0.66 -0.16 1.67 4.07 -0.22 0.64 115.31 121.46 2cnp h LEU 12 Ca 0.02 -0.00 0.02 0.00 0.08 0.00 0.00 57.88 57.99 2cnp h LEU 12 Cb 0.50 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 42.07 2cnp h LEU 12 CO -0.11 0.46 0.02 0.40 -1.08 0.00 0.00 178.44 178.13 2cnp h ILE 13 N 0.79 0.92 -0.09 1.22 2.04 -0.71 -0.53 117.51 121.15 2cnp h ILE 13 Ca 0.25 -0.03 0.03 0.00 1.00 0.00 0.00 64.86 66.11 2cnp h ILE 13 Cb -0.01 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 2cnp h ILE 13 CO -0.09 0.02 -0.12 1.23 0.00 0.00 0.00 178.15 179.18 2cnp h GLY 14 N 0.09 -0.07 0.48 5.37 0.00 0.30 0.13 103.07 109.37 2cnp h GLY 14 Ca 0.07 0.15 0.06 0.00 0.00 0.00 0.00 47.33 47.61 2cnp h GLY 14 CO -0.10 -0.13 -0.02 -2.22 0.00 0.00 0.00 176.54 174.07 2cnp h ILE 15 N -0.17 0.75 0.06 2.60 1.08 -0.81 0.17 117.51 121.20 2cnp h ILE 15 Ca 0.07 -0.02 0.03 0.00 -0.39 0.00 0.00 64.86 64.55 2cnp h ILE 15 Cb 0.27 0.68 -0.05 0.00 -3.07 0.00 0.00 36.82 34.66 2cnp h ILE 15 CO -0.19 0.01 -0.33 0.15 -0.69 0.00 0.00 178.15 177.10 2cnp h PHE 16 N 0.07 -0.91 -0.17 1.37 3.57 -0.29 -2.72 116.94 117.85 2cnp h PHE 16 Ca 0.15 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 2cnp h PHE 16 Cb 0.21 0.39 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 2cnp h PHE 16 CO -0.24 -0.43 -0.15 1.25 -2.23 0.00 0.00 178.31 176.51 2cnp h HIS 17 N -0.52 0.29 -0.37 0.41 2.76 -0.39 0.61 115.15 117.93 2cnp h HIS 17 Ca 0.04 -0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.25 2cnp h HIS 17 Cb 0.58 -0.08 -0.07 0.00 1.55 0.00 0.00 27.41 29.39 2cnp h HIS 17 CO -0.32 0.42 -0.06 -0.22 -1.30 0.00 0.00 177.93 176.44 2cnp h LYS 18 N 0.26 0.03 0.08 5.26 3.64 -0.34 0.46 116.57 125.96 2cnp h LYS 18 Ca 0.05 -0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.09 2cnp h LYS 18 Cb 0.42 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 2cnp h LYS 18 CO 0.03 0.02 -1.87 1.88 -2.27 0.00 0.00 179.45 177.24 2cnp h TYR 19 N 0.03 0.30 -0.13 1.91 -1.99 -1.41 -3.31 116.97 112.38 2cnp h TYR 19 Ca 0.18 -0.22 -0.04 0.00 2.00 0.00 0.00 58.73 60.65 2cnp h TYR 19 Cb 0.27 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.97 2cnp h TYR 19 CO -0.31 1.47 -0.11 1.03 -0.00 0.00 0.00 178.16 180.25 2cnp h SER 20 N 0.05 0.18 -1.27 3.88 0.87 -0.88 -3.30 113.55 113.07 2cnp h SER 20 Ca -0.36 -0.03 0.46 0.00 -1.23 0.00 0.00 61.79 60.63 2cnp h SER 20 Cb 2.03 -0.05 -0.15 0.00 -0.44 0.00 0.00 62.40 63.79 2cnp h SER 20 CO 0.09 0.32 0.79 0.61 -0.53 0.00 0.00 176.83 178.10 2cnp n GLY 21 N -0.98 -0.82 0.23 5.77 0.00 0.16 -0.53 105.19 109.02 2cnp n GLY 21 Ca -0.01 0.77 0.13 0.00 0.00 0.00 0.00 46.02 46.91 2cnp n GLY 21 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2cnp h LYS 22 N 0.00 0.00 -7.58 1.61 2.10 -1.80 -3.47 116.57 107.44 2cnp h LYS 22 Ca 0.87 0.00 -0.46 0.00 -2.00 0.00 0.00 60.65 59.06 2cnp h LYS 22 Cb 2.68 0.00 0.12 0.00 -0.90 0.00 0.00 32.23 34.12 2cnp h LYS 22 CO -0.55 0.03 0.35 -1.21 -2.00 0.00 0.00 179.45 176.07 2cnp s GLU 23 N -3.30 1.53 0.01 0.07 2.02 0.32 -5.03 118.70 114.32 2cnp s GLU 23 Ca 0.06 -0.26 -0.25 0.00 0.02 0.00 0.00 54.97 54.54 2cnp s GLU 23 Cb 0.06 -2.00 -0.14 0.00 0.10 0.00 0.00 34.13 32.16 2cnp s GLU 23 CO 0.65 -1.79 1.08 0.78 0.02 0.00 0.00 175.26 176.00 2cnp h GLY 24 N -1.12 -0.95 -7.28 -1.39 0.00 -1.90 -3.36 103.07 87.08 2cnp h GLY 24 Ca -0.44 0.35 -0.64 0.00 0.00 0.00 0.00 47.33 46.60 2cnp h GLY 24 CO 0.53 -0.34 1.14 0.99 0.00 0.00 0.00 176.54 178.85 2cnp s ASP 25 N -4.31 6.55 0.00 0.19 1.11 -1.26 -4.90 116.67 114.04 2cnp s ASP 25 Ca -0.13 -1.70 0.00 0.00 0.18 0.00 0.00 52.55 50.89 2cnp s ASP 25 Cb 0.01 -2.48 0.00 0.00 1.07 0.00 0.00 42.92 41.52 2cnp s ASP 25 CO 0.40 -1.30 1.39 0.29 1.18 0.00 0.00 175.17 177.13 2cnp n LYS 26 N 7.73 0.81 -2.51 8.23 5.02 -1.26 -2.35 118.16 133.82 2cnp n LYS 26 Ca 0.27 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.55 2cnp n LYS 26 Cb 0.50 -1.10 0.07 0.00 -0.02 0.00 0.00 35.03 34.48 2cnp n LYS 26 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 2cnp n HIS 27 N 1.32 -0.44 -3.62 2.13 1.44 -1.26 -4.46 115.22 110.34 2cnp n HIS 27 Ca 0.00 -1.70 -0.14 0.00 -2.01 0.00 0.00 57.72 53.88 2cnp n HIS 27 Cb 0.40 0.64 -0.07 0.00 0.12 0.00 0.00 29.99 31.09 2cnp n HIS 27 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 2cnp s THR 28 N -1.45 0.00 0.34 0.61 -4.23 -0.99 -3.98 115.64 105.94 2cnp s THR 28 Ca 0.17 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.50 2cnp s THR 28 Cb 0.36 -1.00 0.04 0.00 1.34 0.00 0.00 72.50 73.24 2cnp s THR 28 CO -0.09 0.00 0.76 -1.48 -0.54 0.00 0.00 174.62 173.27 2cnp s LEU 29 N 0.11 -0.12 0.42 4.79 0.05 -0.59 -4.74 118.68 118.61 2cnp s LEU 29 Ca -0.01 -0.90 0.04 0.00 0.05 0.00 0.00 54.13 53.30 2cnp s LEU 29 Cb -0.04 2.80 -0.04 0.00 -2.05 0.00 0.00 46.19 46.85 2cnp s LEU 29 CO 0.01 -1.54 0.05 -0.94 -0.55 0.00 0.00 176.35 173.38 2cnp s SER 30 N -3.00 3.29 0.09 1.48 1.04 -1.26 0.11 113.70 115.45 2cnp s SER 30 Ca 0.13 -1.53 -0.06 0.00 0.48 0.00 0.00 55.95 54.98 2cnp s SER 30 Cb -0.06 0.17 0.10 0.00 0.10 0.00 0.00 66.02 66.34 2cnp s SER 30 CO 0.09 -0.73 0.57 2.29 0.98 0.00 0.00 173.24 176.45 2cnp n LYS 31 N -0.97 -0.08 0.15 4.02 2.85 -1.24 -0.21 118.16 122.68 2cnp n LYS 31 Ca -0.09 0.57 -0.14 0.00 -1.05 0.00 0.00 58.31 57.61 2cnp n LYS 31 Cb 0.66 -0.85 -0.06 0.00 -0.65 0.00 0.00 35.03 34.13 2cnp n LYS 31 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 2cnp h LYS 32 N 0.00 -0.51 -0.27 -1.58 1.63 -1.96 0.11 116.57 113.99 2cnp h LYS 32 Ca 0.14 0.03 -0.08 0.00 -0.85 0.00 0.00 60.65 59.89 2cnp h LYS 32 Cb 0.23 0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 31.96 2cnp h LYS 32 CO -0.37 -0.34 -0.17 0.93 -3.45 0.00 0.00 179.45 176.05 2cnp h GLU 33 N -0.53 0.47 0.00 1.90 3.07 -0.99 0.40 114.58 118.91 2cnp h GLU 33 Ca 0.01 -0.15 -0.00 0.00 -0.50 0.00 0.00 59.36 58.72 2cnp h GLU 33 Cb 0.52 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 2cnp h GLU 33 CO -0.11 0.63 -0.00 -0.07 -1.40 0.00 0.00 179.01 178.06 2cnp h LEU 34 N 0.43 -0.01 -0.21 1.33 3.38 -0.58 0.30 115.31 119.96 2cnp h LEU 34 Ca 0.08 -0.25 0.03 0.00 0.09 0.00 0.00 57.88 57.82 2cnp h LEU 34 Cb 0.55 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2cnp h LEU 34 CO 0.04 0.25 0.02 0.11 0.09 0.00 0.00 178.44 178.95 2cnp h LYS 35 N -0.26 0.10 -0.03 1.13 1.57 -0.83 -0.54 116.57 117.71 2cnp h LYS 35 Ca -0.00 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.81 2cnp h LYS 35 Cb 0.26 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.50 2cnp h LYS 35 CO 0.00 0.06 -0.29 1.49 -0.57 0.00 0.00 179.45 180.14 2cnp h GLU 36 N 0.10 -0.41 -0.07 3.15 4.81 -0.83 -0.68 114.58 120.65 2cnp h GLU 36 Ca 0.10 0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 2cnp h GLU 36 Cb 0.11 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 2cnp h GLU 36 CO -0.15 -0.27 -0.26 -0.07 -0.73 0.00 0.00 179.01 177.53 2cnp h LEU 37 N -0.42 -0.82 -0.53 1.64 3.38 -0.14 0.13 115.31 118.54 2cnp h LEU 37 Ca 0.07 0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.15 2cnp h LEU 37 Cb 0.52 0.32 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 2cnp h LEU 37 CO -0.27 -0.23 0.35 -0.29 0.09 0.00 0.00 178.44 178.09 2cnp h ILE 38 N -0.27 1.13 0.35 1.22 2.10 -0.97 0.73 117.51 121.80 2cnp h ILE 38 Ca 0.02 -0.24 -0.02 0.00 1.08 0.00 0.00 64.86 65.69 2cnp h ILE 38 Cb 0.32 0.35 0.00 0.00 -1.09 0.00 0.00 36.82 36.41 2cnp h ILE 38 CO -0.21 0.13 -0.17 -0.61 -1.08 0.00 0.00 178.15 176.21 2cnp h GLN 39 N 0.71 -0.46 -0.04 2.19 4.15 -0.97 0.17 115.11 120.87 2cnp h GLN 39 Ca 0.20 0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.64 2cnp h GLN 39 Cb -0.07 0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.72 2cnp h GLN 39 CO -0.05 -0.30 -0.01 0.87 -1.93 0.00 0.00 178.83 177.41 2cnp h LYS 40 N -0.48 0.08 0.14 1.69 6.56 -0.48 -3.14 116.57 120.93 2cnp h LYS 40 Ca -0.05 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.50 2cnp h LYS 40 Cb 0.37 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.03 2cnp h LYS 40 CO 0.08 0.45 -0.07 0.93 -2.06 0.00 0.00 179.45 178.78 2cnp h GLU 41 N -0.29 -0.18 -3.31 3.15 4.39 -0.89 -3.36 114.58 114.10 2cnp h GLU 41 Ca 0.01 0.01 -0.75 0.00 0.34 0.00 0.00 59.36 58.98 2cnp h GLU 41 Cb 0.42 0.04 -0.13 0.00 -0.10 0.00 0.00 28.75 28.98 2cnp h GLU 41 CO 0.00 -0.12 2.30 1.28 -1.16 0.00 0.00 179.01 181.31 2cnp n LEU 42 N -3.50 7.10 -0.02 1.33 4.77 0.59 -4.78 117.00 122.51 2cnp n LEU 42 Ca -0.02 -4.65 -0.07 0.00 -0.03 0.00 0.00 56.01 51.23 2cnp n LEU 42 Cb 0.07 -1.47 -0.05 0.00 -2.33 0.00 0.00 43.42 39.64 2cnp n LEU 42 CO 0.05 1.55 0.50 0.71 -1.33 0.00 0.00 177.39 178.88 2cnp h THR 43 N 3.46 0.00 0.00 -5.08 1.35 -1.66 -3.41 112.91 107.56 2cnp h THR 43 Ca 0.50 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.36 2cnp h THR 43 Cb 0.54 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.96 2cnp h THR 43 CO 1.62 0.00 0.00 -0.38 -0.25 0.00 0.00 175.52 176.51 2cnp n ILE 44 N -4.00 0.00 0.00 6.82 5.41 -1.26 -4.81 119.36 121.52 2cnp n ILE 44 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.72 2cnp n ILE 44 Cb 0.18 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.11 2cnp n ILE 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2cnp n GLY 45 N 0.00 1.32 3.40 7.39 0.00 -1.26 -4.67 105.19 111.37 2cnp n GLY 45 Ca 0.00 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 2cnp n GLY 45 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cnp n SER 46 N 2.87 2.54 -4.52 1.61 7.64 -1.26 -4.88 113.62 117.62 2cnp n SER 46 Ca 0.00 -2.66 -0.27 0.00 1.01 0.00 0.00 58.87 56.96 2cnp n SER 46 Cb 0.00 -1.40 -0.15 0.00 -1.01 0.00 0.00 64.21 61.65 2cnp n SER 46 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2cnp n LYS 47 N 7.79 0.28 -0.18 1.43 4.76 -1.26 -4.81 118.16 126.16 2cnp n LYS 47 Ca 0.46 -0.20 -0.06 0.00 -2.87 0.00 0.00 58.31 55.64 2cnp n LYS 47 Cb 0.44 -2.10 -0.01 0.00 -1.84 0.00 0.00 35.03 31.53 2cnp n LYS 47 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2cnp h LEU 48 N 15.17 -1.19 -7.14 -0.35 3.38 -1.95 -3.45 115.31 119.77 2cnp h LEU 48 Ca -0.03 0.22 0.12 0.00 0.09 0.00 0.00 57.88 58.28 2cnp h LEU 48 Cb 1.16 0.57 -0.14 0.00 0.09 0.00 0.00 40.66 42.35 2cnp h LEU 48 CO 1.36 -0.31 0.48 -1.58 0.09 0.00 0.00 178.44 178.47 2cnp s GLN 49 N -5.97 0.92 0.33 1.13 -0.44 -1.26 -5.07 119.66 109.30 2cnp s GLN 49 Ca -0.14 -0.38 0.17 0.00 -2.50 0.00 0.00 55.36 52.50 2cnp s GLN 49 Cb 0.15 0.39 1.16 0.00 -1.64 0.00 0.00 33.01 33.07 2cnp s GLN 49 CO 0.68 -0.41 1.43 -0.40 0.50 0.00 0.00 175.29 177.09 2cnp n ASP 50 N -0.30 0.27 -0.21 6.67 5.75 -1.26 -3.19 116.55 124.28 2cnp n ASP 50 Ca -0.09 1.51 -0.05 0.00 -0.01 0.00 0.00 54.79 56.15 2cnp n ASP 50 Cb 0.62 -0.71 -0.04 0.00 -1.03 0.00 0.00 41.12 39.95 2cnp n ASP 50 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2cnp n ALA 51 N -2.44 -0.30 -0.23 2.12 0.00 -1.26 -0.52 120.51 117.89 2cnp n ALA 51 Ca 0.33 0.42 -0.09 0.00 0.00 0.00 0.00 53.44 54.11 2cnp n ALA 51 Cb 1.11 -0.08 0.03 0.00 0.00 0.00 0.00 19.45 20.51 2cnp n ALA 51 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2cnp h GLU 52 N 0.00 1.08 0.15 0.00 4.81 -1.87 0.14 114.58 118.90 2cnp h GLU 52 Ca 0.09 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.00 2cnp h GLU 52 Cb 0.21 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.47 2cnp h GLU 52 CO -0.47 1.02 -0.07 0.82 -0.73 0.00 0.00 179.01 179.58 2cnp h ILE 53 N 1.00 0.94 -0.73 2.32 5.03 -1.06 -0.81 117.51 124.20 2cnp h ILE 53 Ca 0.19 -0.40 0.09 0.00 -0.12 0.00 0.00 64.86 64.61 2cnp h ILE 53 Cb 0.49 1.19 -0.07 0.00 -3.03 0.00 0.00 36.82 35.40 2cnp h ILE 53 CO 0.02 0.10 0.38 0.58 -0.68 0.00 0.00 178.15 178.54 2cnp h VAL 54 N -0.40 0.88 0.18 1.67 2.07 -0.57 0.34 116.25 120.42 2cnp h VAL 54 Ca -0.02 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.28 2cnp h VAL 54 Cb 0.31 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 2cnp h VAL 54 CO 0.03 0.12 -0.25 0.11 0.02 0.00 0.00 177.57 177.60 2cnp h LYS 55 N 0.65 -0.48 -1.01 1.57 6.56 -0.46 0.30 116.57 123.71 2cnp h LYS 55 Ca 0.35 0.03 0.13 0.00 -1.06 0.00 0.00 60.65 60.10 2cnp h LYS 55 Cb 0.33 0.11 -0.09 0.00 -0.57 0.00 0.00 32.23 32.01 2cnp h LYS 55 CO -0.25 -0.32 0.63 -0.07 -2.06 0.00 0.00 179.45 177.38 2cnp h LEU 56 N -0.49 0.91 0.29 2.94 3.38 -0.11 0.28 115.31 122.51 2cnp h LEU 56 Ca 0.01 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2cnp h LEU 56 Cb 0.49 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2cnp h LEU 56 CO -0.10 0.47 -0.14 0.24 0.09 0.00 0.00 178.44 179.00 2cnp h MET 57 N 0.97 -0.37 -1.00 1.13 2.86 -0.60 -3.33 114.93 114.58 2cnp h MET 57 Ca 0.51 0.03 0.40 0.00 -2.06 0.00 0.00 59.70 58.57 2cnp h MET 57 Cb 0.54 0.09 -0.18 0.00 0.06 0.00 0.00 31.60 32.11 2cnp h MET 57 CO -0.28 -0.25 0.51 0.22 1.06 0.00 0.00 176.91 178.17 2cnp h ASP 58 N -0.60 0.29 -0.92 1.22 3.58 -0.14 0.09 116.42 119.94 2cnp h ASP 58 Ca -0.04 0.25 0.21 0.00 0.42 0.00 0.00 57.03 57.88 2cnp h ASP 58 Cb 0.30 0.27 -0.17 0.00 1.72 0.00 0.00 39.33 41.44 2cnp h ASP 58 CO 0.07 -0.39 -0.12 -0.67 -2.88 0.00 0.00 179.24 175.24 2cnp n ASP 59 N -5.25 -0.24 -0.24 2.28 2.03 0.06 -0.48 116.55 114.71 2cnp n ASP 59 Ca 0.36 1.58 -0.02 0.00 0.52 0.00 0.00 54.79 57.23 2cnp n ASP 59 Cb 1.21 -0.52 0.18 0.00 -0.72 0.00 0.00 41.12 41.27 2cnp n ASP 59 CO 0.00 0.00 0.00 0.17 -1.92 0.00 0.00 177.20 175.45 2cnp h LEU 60 N 0.00 0.95 0.02 -2.67 8.10 -1.17 0.96 115.31 121.50 2cnp h LEU 60 Ca 0.49 -0.07 -0.00 0.00 0.11 0.00 0.00 57.88 58.41 2cnp h LEU 60 Cb 0.88 -0.24 0.00 0.00 -0.44 0.00 0.00 40.66 40.86 2cnp h LEU 60 CO -0.91 0.76 -0.01 -0.78 -4.11 0.00 0.00 178.44 173.38 2cnp h ASP 61 N 1.07 -0.03 -0.71 0.17 3.58 -0.95 -3.22 116.42 116.33 2cnp h ASP 61 Ca 0.27 -0.71 0.16 0.00 0.42 0.00 0.00 57.03 57.17 2cnp h ASP 61 Cb 0.02 0.01 -0.11 0.00 1.72 0.00 0.00 39.33 40.96 2cnp h ASP 61 CO -0.05 0.74 0.09 -0.09 -2.88 0.00 0.00 179.24 177.05 2cnp h ARG 62 N -0.84 0.18 -0.99 0.28 2.43 -0.73 -0.00 114.38 114.71 2cnp h ARG 62 Ca -0.00 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.01 2cnp h ARG 62 Cb 0.74 -0.04 -0.09 0.00 -0.42 0.00 0.00 29.97 30.16 2cnp h ARG 62 CO 0.01 0.12 0.19 0.09 -1.51 0.00 0.00 179.97 178.86 2cnp n ASN 63 N -5.24 3.16 -0.16 -3.80 3.02 0.32 -3.92 115.26 108.65 2cnp n ASN 63 Ca 0.13 -2.48 0.07 0.00 -0.03 0.00 0.00 54.58 52.27 2cnp n ASN 63 Cb 0.44 -0.60 0.38 0.00 -0.61 0.00 0.00 39.78 39.39 2cnp n ASN 63 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 2cnp h LYS 64 N 0.40 0.66 0.00 3.52 2.10 -1.00 0.19 116.57 122.45 2cnp h LYS 64 Ca 0.18 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 2cnp h LYS 64 Cb 1.53 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 32.71 2cnp h LYS 64 CO 0.33 0.44 0.00 -0.25 -2.00 0.00 0.00 179.45 177.97 2cnp n ASP 65 N -4.48 0.00 0.00 7.07 9.92 -1.25 -4.92 116.55 122.89 2cnp n ASP 65 Ca 0.10 -0.98 0.00 0.00 -0.53 0.00 0.00 54.79 53.38 2cnp n ASP 65 Cb 0.24 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.72 2cnp n ASP 65 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cnp n GLN 66 N -0.82 0.00 -3.55 -1.24 1.13 0.68 -4.79 117.38 108.80 2cnp n GLN 66 Ca 0.11 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 54.95 2cnp n GLN 66 Cb 0.05 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.39 2cnp n GLN 66 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2cnp s GLU 67 N 0.00 3.31 0.03 -1.09 8.01 -1.26 -3.68 118.70 124.02 2cnp s GLU 67 Ca 0.00 -0.68 0.01 0.00 0.01 0.00 0.00 54.97 54.31 2cnp s GLU 67 Cb 0.00 -2.77 -0.02 0.00 -4.31 0.00 0.00 34.13 27.03 2cnp s GLU 67 CO 0.00 0.16 -0.06 0.14 0.01 0.00 0.00 175.26 175.51 2cnp s VAL 68 N -2.20 0.39 0.73 2.63 -7.23 0.12 -4.92 120.40 109.91 2cnp s VAL 68 Ca 0.40 -0.99 -0.03 0.00 -1.81 0.00 0.00 61.98 59.55 2cnp s VAL 68 Cb -0.09 -0.48 0.12 0.00 0.56 0.00 0.00 36.38 36.48 2cnp s VAL 68 CO 0.33 -0.41 1.02 0.54 -0.31 0.00 0.00 175.10 176.27 2cnp s ASN 69 N -1.49 4.36 0.08 4.85 2.20 -1.26 -1.54 114.94 122.14 2cnp s ASN 69 Ca -0.12 -0.12 -0.16 0.00 -0.94 0.00 0.00 52.86 51.53 2cnp s ASN 69 Cb -0.10 -0.32 -0.04 0.00 -2.00 0.00 0.00 41.25 38.80 2cnp s ASN 69 CO -0.00 -1.86 1.25 0.33 -2.94 0.00 0.00 177.10 173.88 2cnp n PHE 70 N -2.92 -0.23 0.11 1.54 7.35 -1.26 -0.80 117.46 121.26 2cnp n PHE 70 Ca 0.13 0.64 0.02 0.00 -0.76 0.00 0.00 57.45 57.48 2cnp n PHE 70 Cb 0.60 -0.53 0.36 0.00 0.35 0.00 0.00 39.48 40.26 2cnp n PHE 70 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 2cnp h GLN 71 N 0.00 0.25 -0.37 -4.13 5.75 -1.96 0.18 115.11 114.83 2cnp h GLN 71 Ca 0.08 -0.07 -0.05 0.00 -0.15 0.00 0.00 58.65 58.47 2cnp h GLN 71 Cb 0.21 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.71 2cnp h GLN 71 CO -0.48 0.42 0.06 0.93 -2.65 0.00 0.00 178.83 177.11 2cnp h GLU 72 N 0.24 0.62 0.15 1.69 5.08 -1.76 0.26 114.58 120.85 2cnp h GLU 72 Ca 0.04 -0.17 0.01 0.00 -1.00 0.00 0.00 59.36 58.25 2cnp h GLU 72 Cb 0.44 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2cnp h GLU 72 CO 0.03 0.69 -0.25 -0.92 -1.00 0.00 0.00 179.01 177.55 2cnp h TYR 73 N 0.46 -0.66 -0.62 4.33 3.20 -0.12 -1.91 116.97 121.65 2cnp h TYR 73 Ca 0.11 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.11 2cnp h TYR 73 Cb 0.37 0.27 -0.08 0.00 1.54 0.00 0.00 36.73 38.82 2cnp h TYR 73 CO 0.03 -0.35 0.16 0.82 -1.64 0.00 0.00 178.16 177.17 2cnp h ILE 74 N -0.47 0.66 -0.05 1.81 1.08 -0.49 0.12 117.51 120.17 2cnp h ILE 74 Ca 0.02 -0.10 0.01 0.00 -0.39 0.00 0.00 64.86 64.40 2cnp h ILE 74 Cb 0.48 0.33 -0.00 0.00 -3.07 0.00 0.00 36.82 34.56 2cnp h ILE 74 CO -0.12 0.05 0.04 0.74 -0.69 0.00 0.00 178.15 178.18 2cnp h THR 75 N 0.30 0.75 0.20 -0.27 2.02 -0.09 0.37 112.91 116.20 2cnp h THR 75 Ca 0.32 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.50 2cnp h THR 75 Cb 0.47 0.97 -0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2cnp h THR 75 CO -0.39 0.00 -0.11 0.15 0.37 0.00 0.00 175.52 175.54 2cnp h PHE 76 N 0.00 -0.28 -0.55 3.16 3.57 0.03 0.15 116.94 123.03 2cnp h PHE 76 Ca 0.02 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.40 2cnp h PHE 76 Cb 0.11 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 2cnp h PHE 76 CO 0.00 -0.17 -0.11 -0.07 -2.23 0.00 0.00 178.31 175.72 2cnp h LEU 77 N -0.29 1.05 -0.23 0.59 3.38 -0.91 -0.17 115.31 118.73 2cnp h LEU 77 Ca -0.02 -0.35 -0.07 0.00 0.09 0.00 0.00 57.88 57.53 2cnp h LEU 77 Cb 0.23 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2cnp h LEU 77 CO 0.03 1.16 -0.12 1.23 0.09 0.00 0.00 178.44 180.83 2cnp h GLY 78 N 0.92 0.53 0.96 0.83 0.00 -0.29 0.12 103.07 106.14 2cnp h GLY 78 Ca 0.14 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 2cnp h GLY 78 CO 0.05 0.44 0.08 0.00 0.00 0.00 0.00 176.54 177.11 2cnp h ALA 79 N 0.71 0.17 -0.10 3.60 0.00 -0.67 0.10 119.26 123.07 2cnp h ALA 79 Ca 0.05 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2cnp h ALA 79 Cb 0.63 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 2cnp h ALA 79 CO 0.04 -0.31 -0.41 1.25 0.00 0.00 0.00 179.25 179.81 2cnp h LEU 80 N 0.14 -1.29 -0.24 0.00 5.85 -0.87 0.11 115.31 119.02 2cnp h LEU 80 Ca 0.05 0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.99 2cnp h LEU 80 Cb 0.04 0.52 -0.07 0.00 0.37 0.00 0.00 40.66 41.51 2cnp h LEU 80 CO -0.01 -0.43 -0.33 0.00 -0.34 0.00 0.00 178.44 177.33 2cnp h ALA 81 N 0.10 -0.32 -0.50 1.25 0.00 -0.62 -1.46 119.26 117.71 2cnp h ALA 81 Ca 0.07 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2cnp h ALA 81 Cb 0.63 0.67 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 2cnp h ALA 81 CO -0.38 -0.78 0.33 1.98 0.00 0.00 0.00 179.25 180.40 2cnp h MET 82 N -0.35 0.65 0.23 0.00 1.85 -0.17 0.23 114.93 117.36 2cnp h MET 82 Ca 0.12 -0.04 -0.01 0.00 -0.61 0.00 0.00 59.70 59.16 2cnp h MET 82 Cb 0.55 -0.15 0.00 0.00 0.43 0.00 0.00 31.60 32.43 2cnp h MET 82 CO -0.43 0.43 -0.11 0.82 -0.40 0.00 0.00 176.91 177.22 2cnp h ILE 83 N 0.67 0.84 0.09 1.77 2.04 -0.46 -3.32 117.51 119.14 2cnp h ILE 83 Ca 0.19 -0.45 -0.25 0.00 1.00 0.00 0.00 64.86 65.34 2cnp h ILE 83 Cb -0.07 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.11 2cnp h ILE 83 CO -0.05 0.10 -1.15 0.10 0.00 0.00 0.00 178.15 177.16 2cnp h TYR 84 N -0.54 0.41 -0.27 1.37 -0.00 -1.20 -3.31 116.97 113.43 2cnp h TYR 84 Ca -0.03 -0.29 -0.70 0.00 0.00 0.00 0.00 58.73 57.71 2cnp h TYR 84 Cb 0.40 -0.02 -0.05 0.00 0.00 0.00 0.00 36.73 37.06 2cnp h TYR 84 CO 0.00 1.20 2.86 0.09 -0.00 0.00 0.00 178.16 182.31 2cnp n ASN 85 N -3.53 4.19 -0.34 0.10 3.02 0.79 -4.79 115.26 114.69 2cnp n ASN 85 Ca -0.07 -2.87 0.35 0.00 -0.03 0.00 0.00 54.58 51.97 2cnp n ASN 85 Cb 0.98 -1.68 0.74 0.00 -0.61 0.00 0.00 39.78 39.20 2cnp n ASN 85 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2cnp h GLU 86 N 6.46 0.03 -0.94 3.52 5.08 -1.69 0.13 114.58 127.17 2cnp h GLU 86 Ca 0.53 -0.00 0.25 0.00 -1.00 0.00 0.00 59.36 59.14 2cnp h GLU 86 Cb 0.71 -0.01 -0.18 0.00 0.50 0.00 0.00 28.75 29.78 2cnp h GLU 86 CO 1.76 0.02 -0.01 0.00 -1.00 0.00 0.00 179.01 179.77 2cnp n ALA 87 N -2.76 0.45 1.25 3.43 0.00 -1.26 -0.50 120.51 121.12 2cnp n ALA 87 Ca 0.26 1.01 0.03 0.00 0.00 0.00 0.00 53.44 54.75 2cnp n ALA 87 Cb 1.26 -0.72 0.21 0.00 0.00 0.00 0.00 19.45 20.19 2cnp n ALA 87 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2cnp n LEU 88 N -5.41 0.00 -0.87 0.00 4.77 0.47 -0.67 117.00 115.28 2cnp n LEU 88 Ca 0.21 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.27 2cnp n LEU 88 Cb 0.69 0.00 0.19 0.00 -2.33 0.00 0.00 43.42 41.97 2cnp n LEU 88 CO -0.08 0.00 0.65 0.29 -1.33 0.00 0.00 177.39 176.93 2cnp n LYS 89 N -0.67 2.54 0.00 3.23 5.02 0.35 -4.98 118.16 123.64 2cnp n LYS 89 Ca 0.05 -2.15 0.00 0.00 -2.02 0.00 0.00 58.31 54.19 2cnp n LYS 89 Cb 0.02 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.66 2cnp n LYS 89 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29