#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 2.38 -0.98 -5.12 0.00 -1.26 -4.95 120.51 110.58 2cnp n ALA 2 Ca 0.00 -3.20 -0.34 0.00 0.00 0.00 0.00 53.44 49.89 2cnp n ALA 2 Cb 0.00 -3.52 0.10 0.00 0.00 0.00 0.00 19.45 16.02 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 12.28 -2.01 -0.23 0.00 7.64 -1.26 -4.37 113.62 125.67 2cnp n SER 3 Ca 0.46 0.42 0.01 0.00 1.01 0.00 0.00 58.87 60.77 2cnp n SER 3 Cb 0.45 -1.18 0.09 0.00 -1.01 0.00 0.00 64.21 62.56 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 -1.08 0.02 -0.47 1.43 0.11 -1.99 0.23 132.00 130.25 2cnp h PRO 4 Ca -0.44 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.69 2cnp h PRO 4 Cb 1.31 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.38 2cnp h PRO 4 CO 0.37 0.01 0.27 -0.07 -0.21 0.00 0.00 178.00 178.36 2cnp h LEU 5 N 0.02 0.42 -0.62 2.35 3.38 -1.99 0.48 115.31 119.35 2cnp h LEU 5 Ca 0.34 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.31 2cnp h LEU 5 Cb 0.53 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 2cnp h LEU 5 CO -0.69 0.30 0.35 -0.78 0.09 0.00 0.00 178.44 177.71 2cnp h ASP 6 N 0.54 0.77 -0.02 -0.43 3.58 -0.96 0.17 116.42 120.06 2cnp h ASP 6 Ca 0.19 -0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.56 2cnp h ASP 6 Cb 0.04 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 40.89 2cnp h ASP 6 CO -0.10 0.63 0.01 -0.61 -2.88 0.00 0.00 179.24 176.29 2cnp h GLN 7 N 0.85 0.03 -0.35 0.28 4.15 -0.64 0.16 115.11 119.59 2cnp h GLN 7 Ca 0.22 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.62 2cnp h GLN 7 Cb 0.02 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 2cnp h GLN 7 CO -0.04 0.05 0.17 0.00 -1.93 0.00 0.00 178.83 177.08 2cnp h ALA 8 N 0.97 0.45 -0.20 3.38 0.00 -0.49 0.17 119.26 123.55 2cnp h ALA 8 Ca 0.01 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.86 2cnp h ALA 8 Cb 0.03 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 2cnp h ALA 8 CO -0.00 0.02 -0.15 0.82 0.00 0.00 0.00 179.25 179.94 2cnp h ILE 9 N 0.43 0.58 -0.70 0.00 2.04 -0.64 -1.36 117.51 117.85 2cnp h ILE 9 Ca 0.12 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.13 2cnp h ILE 9 Cb 0.13 0.58 -0.13 0.00 -0.74 0.00 0.00 36.82 36.65 2cnp h ILE 9 CO -0.01 0.00 -0.08 1.23 0.00 0.00 0.00 178.15 179.29 2cnp h GLY 10 N -0.16 0.65 0.56 5.37 0.00 0.17 0.13 103.07 109.80 2cnp h GLY 10 Ca 0.12 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2cnp h GLY 10 CO -0.29 -0.26 -0.35 1.41 0.00 0.00 0.00 176.54 177.04 2cnp h LEU 11 N 0.05 -0.97 -0.76 3.11 3.38 -0.01 0.19 115.31 120.31 2cnp h LEU 11 Ca 0.36 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.46 2cnp h LEU 11 Cb 0.60 0.34 -0.05 0.00 0.09 0.00 0.00 40.66 41.64 2cnp h LEU 11 CO -0.67 -0.48 0.47 -0.07 0.09 0.00 0.00 178.44 177.79 2cnp h LEU 12 N -0.69 0.77 0.13 1.67 4.07 -0.20 0.37 115.31 121.43 2cnp h LEU 12 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2cnp h LEU 12 Cb 0.65 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 2cnp h LEU 12 CO -0.10 0.52 -0.13 0.40 -1.08 0.00 0.00 178.44 178.04 2cnp h ILE 13 N 0.91 0.70 -0.16 1.22 2.04 -0.64 -0.38 117.51 121.19 2cnp h ILE 13 Ca 0.31 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.21 2cnp h ILE 13 Cb 0.06 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 36.80 2cnp h ILE 13 CO -0.13 0.00 -0.08 1.23 0.00 0.00 0.00 178.15 179.17 2cnp h GLY 14 N -0.29 0.06 0.29 5.37 0.00 0.10 0.15 103.07 108.74 2cnp h GLY 14 Ca 0.01 0.10 0.08 0.00 0.00 0.00 0.00 47.33 47.52 2cnp h GLY 14 CO -0.04 -0.10 -0.00 -2.22 0.00 0.00 0.00 176.54 174.17 2cnp h ILE 15 N -0.07 0.67 0.49 2.60 1.08 -0.90 0.71 117.51 122.10 2cnp h ILE 15 Ca 0.09 -0.04 -0.01 0.00 -0.39 0.00 0.00 64.86 64.51 2cnp h ILE 15 Cb 0.21 0.55 -0.02 0.00 -3.07 0.00 0.00 36.82 34.49 2cnp h ILE 15 CO -0.21 0.02 -0.47 0.15 -0.69 0.00 0.00 178.15 176.95 2cnp h PHE 16 N 0.10 -1.28 -1.00 1.37 3.57 -0.03 -3.01 116.94 116.66 2cnp h PHE 16 Ca 0.21 0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.83 2cnp h PHE 16 Cb 0.31 0.50 -0.08 0.00 2.79 0.00 0.00 35.95 39.46 2cnp h PHE 16 CO -0.29 -0.64 0.63 1.25 -2.23 0.00 0.00 178.31 177.04 2cnp h HIS 17 N -0.96 1.15 -1.10 0.41 2.76 -0.33 0.19 115.15 117.26 2cnp h HIS 17 Ca -0.06 0.03 0.30 0.00 -2.20 0.00 0.00 60.37 58.45 2cnp h HIS 17 Cb 0.83 -0.37 -0.08 0.00 1.55 0.00 0.00 27.41 29.34 2cnp h HIS 17 CO -0.23 0.49 0.73 -0.22 -1.30 0.00 0.00 177.93 177.41 2cnp h LYS 18 N 1.03 0.25 0.00 5.26 3.64 -0.72 0.65 116.57 126.68 2cnp h LYS 18 Ca 0.48 -0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.65 2cnp h LYS 18 Cb 0.41 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 2cnp h LYS 18 CO -0.24 0.16 -1.51 0.66 -2.27 0.00 0.00 179.45 176.25 2cnp n TYR 19 N -4.50 0.00 -0.32 1.91 4.02 -0.82 -4.74 117.16 112.71 2cnp n TYR 19 Ca 0.26 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 58.13 2cnp n TYR 19 Cb 1.02 -0.53 0.14 0.00 -0.02 0.00 0.00 39.34 39.95 2cnp n TYR 19 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 2cnp h SER 20 N -0.64 1.07 0.00 7.72 0.02 -0.60 -3.32 113.55 117.80 2cnp h SER 20 Ca -0.29 -0.06 -0.39 0.00 -0.84 0.00 0.00 61.79 60.21 2cnp h SER 20 Cb 1.13 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.38 2cnp h SER 20 CO -0.18 0.81 1.82 0.61 -1.14 0.00 0.00 176.83 178.76 2cnp n GLY 21 N -1.29 3.37 1.03 -3.77 0.00 0.21 -2.97 105.19 101.78 2cnp n GLY 21 Ca 0.10 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.94 2cnp n GLY 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2cnp n LYS 22 N 3.25 0.00 -0.47 1.61 5.02 -1.25 -4.96 118.16 121.36 2cnp n LYS 22 Ca 0.54 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.81 2cnp n LYS 22 Cb 0.46 -0.12 -0.03 0.00 -0.02 0.00 0.00 35.03 35.32 2cnp n LYS 22 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2cnp n GLU 23 N -2.02 0.94 0.00 1.97 0.28 -1.16 -4.82 120.64 115.84 2cnp n GLU 23 Ca 0.00 -0.18 0.00 0.00 -0.16 0.00 0.00 57.16 56.82 2cnp n GLU 23 Cb 0.00 -1.30 0.00 0.00 1.43 0.00 0.00 31.44 31.57 2cnp n GLU 23 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2cnp n GLY 24 N 1.86 0.87 3.58 -1.84 0.00 -1.26 -4.56 105.19 103.83 2cnp n GLY 24 Ca 0.08 0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 2cnp n GLY 24 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cnp s ASP 25 N -0.49 6.47 0.58 1.61 -1.08 -1.26 -4.79 116.67 117.71 2cnp s ASP 25 Ca 0.00 -2.19 0.33 0.00 -0.52 0.00 0.00 52.55 50.17 2cnp s ASP 25 Cb 0.00 -2.58 1.40 0.00 -1.46 0.00 0.00 42.92 40.28 2cnp s ASP 25 CO 0.00 -1.55 1.70 0.11 0.52 0.00 0.00 175.17 175.94 2cnp h LYS 26 N 8.22 0.00 -0.00 4.34 1.57 -1.81 -1.15 116.57 127.74 2cnp h LYS 26 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 2cnp h LYS 26 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.21 2cnp h LYS 26 CO 1.41 0.00 -0.06 0.72 -0.57 0.00 0.00 179.45 180.95 2cnp n HIS 27 N -3.77 0.00 -4.40 -1.35 8.25 -1.26 -3.59 115.22 109.10 2cnp n HIS 27 Ca 0.21 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.47 2cnp n HIS 27 Cb 1.19 -0.23 -0.10 0.00 1.12 0.00 0.00 29.99 31.97 2cnp n HIS 27 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2cnp s THR 28 N -2.52 1.52 0.32 1.59 -4.23 -0.44 -2.37 115.64 109.51 2cnp s THR 28 Ca 0.29 -2.11 -0.12 0.00 -1.18 0.00 0.00 61.69 58.56 2cnp s THR 28 Cb 0.20 -2.39 0.02 0.00 1.34 0.00 0.00 72.50 71.67 2cnp s THR 28 CO 0.47 -0.33 0.60 -1.48 -0.54 0.00 0.00 174.62 173.34 2cnp s LEU 29 N -3.40 0.32 0.31 4.79 0.05 -0.46 -4.61 118.68 115.68 2cnp s LEU 29 Ca 0.28 -1.08 0.05 0.00 0.05 0.00 0.00 54.13 53.43 2cnp s LEU 29 Cb 0.04 2.15 -0.06 0.00 -2.05 0.00 0.00 46.19 46.26 2cnp s LEU 29 CO 0.11 -1.37 0.01 -0.94 -0.55 0.00 0.00 176.35 173.61 2cnp s SER 30 N -3.07 2.56 0.08 1.48 1.04 -1.26 -0.34 113.70 114.19 2cnp s SER 30 Ca 0.21 -1.31 -0.16 0.00 0.48 0.00 0.00 55.95 55.16 2cnp s SER 30 Cb -0.03 -0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.93 2cnp s SER 30 CO 0.12 -0.51 0.90 2.29 0.98 0.00 0.00 173.24 177.02 2cnp n LYS 31 N -0.66 -0.23 -0.15 4.02 2.85 -1.26 -0.61 118.16 122.13 2cnp n LYS 31 Ca -0.04 0.88 -0.03 0.00 -1.05 0.00 0.00 58.31 58.07 2cnp n LYS 31 Cb 0.65 -1.30 0.06 0.00 -0.65 0.00 0.00 35.03 33.79 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 0.27 -0.81 -1.58 1.63 -1.97 0.98 116.57 115.09 2cnp h LYS 32 Ca 0.08 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.85 2cnp h LYS 32 Cb 0.22 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 31.75 2cnp h LYS 32 CO -0.50 0.18 0.43 0.93 -3.45 0.00 0.00 179.45 177.04 2cnp h GLU 33 N 0.28 1.13 -0.13 1.90 5.08 -1.27 0.69 114.58 122.26 2cnp h GLU 33 Ca 0.23 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2cnp h GLU 33 Cb 0.27 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2cnp h GLU 33 CO -0.27 0.85 0.05 -0.07 -1.00 0.00 0.00 179.01 178.57 2cnp h LEU 34 N 1.13 0.18 -1.20 1.33 3.38 -0.20 0.23 115.31 120.15 2cnp h LEU 34 Ca 0.28 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2cnp h LEU 34 Cb 0.06 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2cnp h LEU 34 CO -0.04 0.29 0.27 0.11 0.09 0.00 0.00 178.44 179.16 2cnp h LYS 35 N 0.06 0.82 0.31 1.13 1.57 -0.51 -0.29 116.57 119.66 2cnp h LYS 35 Ca 0.04 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2cnp h LYS 35 Cb 0.16 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2cnp h LYS 35 CO -0.00 0.65 -0.15 0.93 -0.57 0.00 0.00 179.45 180.30 2cnp h GLU 36 N 0.82 -0.40 0.00 3.15 3.07 -0.73 -3.15 114.58 117.33 2cnp h GLU 36 Ca 0.20 0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 2cnp h GLU 36 Cb 0.10 0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 2cnp h GLU 36 CO -0.03 -0.11 0.00 1.28 -1.40 0.00 0.00 179.01 178.76 2cnp n LEU 37 N -5.16 0.00 -0.13 1.33 4.77 0.80 -0.36 117.00 118.26 2cnp n LEU 37 Ca -0.10 0.90 -0.04 0.00 -0.03 0.00 0.00 56.01 56.74 2cnp n LEU 37 Cb 0.25 -0.40 0.02 0.00 -2.33 0.00 0.00 43.42 40.96 2cnp n LEU 37 CO 0.32 -0.40 0.76 -0.29 -1.33 0.00 0.00 177.39 176.44 2cnp h ILE 38 N 0.00 0.50 -0.51 -0.08 2.10 -1.21 0.14 117.51 118.45 2cnp h ILE 38 Ca 0.00 0.00 0.08 0.00 1.08 0.00 0.00 64.86 66.02 2cnp h ILE 38 Cb 0.00 0.50 -0.07 0.00 -1.09 0.00 0.00 36.82 36.16 2cnp h ILE 38 CO 0.00 0.00 0.13 -0.61 -1.08 0.00 0.00 178.15 176.59 2cnp h GLN 39 N -0.05 0.26 0.13 2.19 4.15 -1.48 -0.01 115.11 120.31 2cnp h GLN 39 Ca 0.21 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.61 2cnp h GLN 39 Cb 0.37 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.00 2cnp h GLN 39 CO -0.47 0.18 -0.06 0.87 -1.93 0.00 0.00 178.83 177.42 2cnp h LYS 40 N 0.27 -0.17 -0.00 1.69 6.56 0.13 -3.39 116.57 121.66 2cnp h LYS 40 Ca 0.25 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.85 2cnp h LYS 40 Cb 0.32 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.02 2cnp h LYS 40 CO -0.31 0.24 -0.43 -0.85 -2.06 0.00 0.00 179.45 176.05 2cnp n GLU 41 N -4.87 0.42 -3.86 3.15 -0.00 0.27 -4.19 120.64 111.57 2cnp n GLU 41 Ca -0.06 -0.26 -0.30 0.00 -0.00 0.00 0.00 57.16 56.53 2cnp n GLU 41 Cb 0.24 -1.49 -0.11 0.00 -0.00 0.00 0.00 31.44 30.07 2cnp n GLU 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2cnp s LEU 42 N -2.76 4.92 -1.32 -1.84 1.43 -0.02 -4.99 118.68 114.10 2cnp s LEU 42 Ca 0.17 -3.73 -0.10 0.00 -1.03 0.00 0.00 54.13 49.44 2cnp s LEU 42 Cb 0.18 -1.69 -0.07 0.00 0.03 0.00 0.00 46.19 44.64 2cnp s LEU 42 CO 0.63 -0.12 2.53 0.35 0.23 0.00 0.00 176.35 179.96 2cnp n THR 43 N 2.18 3.43 -0.06 5.49 -2.24 -1.26 -4.49 114.28 117.33 2cnp n THR 43 Ca 0.18 -2.19 -0.04 0.00 -2.27 0.00 0.00 64.05 59.73 2cnp n THR 43 Cb 0.35 -2.44 -0.02 0.00 -2.10 0.00 0.00 70.33 66.12 2cnp n THR 43 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2cnp h ILE 44 N 3.36 0.16 0.00 2.28 2.04 -1.91 -3.47 117.51 119.96 2cnp h ILE 44 Ca 0.69 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 65.40 2cnp h ILE 44 Cb 0.31 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2cnp h ILE 44 CO 1.70 0.05 0.00 0.61 0.00 0.00 0.00 178.15 180.51 2cnp n GLY 45 N 1.67 1.29 3.51 5.37 0.00 -1.26 -4.64 105.19 111.12 2cnp n GLY 45 Ca -0.06 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 2cnp n GLY 45 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cnp n SER 46 N 2.73 3.14 -4.54 1.61 3.41 -1.26 -4.88 113.62 113.82 2cnp n SER 46 Ca 0.00 -2.71 -0.28 0.00 -0.26 0.00 0.00 58.87 55.62 2cnp n SER 46 Cb 0.00 -1.65 -0.08 0.00 -0.26 0.00 0.00 64.21 62.22 2cnp n SER 46 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2cnp n LYS 47 N 8.09 0.63 -0.22 4.33 5.02 -1.26 -4.82 118.16 129.92 2cnp n LYS 47 Ca 0.46 -0.27 -0.00 0.00 -2.02 0.00 0.00 58.31 56.48 2cnp n LYS 47 Cb 0.46 -2.99 0.03 0.00 -0.02 0.00 0.00 35.03 32.51 2cnp n LYS 47 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2cnp n LEU 48 N 14.95 -0.36 -3.97 -0.35 4.77 -1.26 -4.61 117.00 126.16 2cnp n LEU 48 Ca 0.48 1.00 -0.09 0.00 -0.03 0.00 0.00 56.01 57.37 2cnp n LEU 48 Cb 0.39 -0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 41.20 2cnp n LEU 48 CO 0.73 -0.90 0.24 -1.58 -1.33 0.00 0.00 177.39 174.55 2cnp s GLN 49 N -5.55 1.59 0.44 3.23 0.74 -1.26 -5.05 119.66 113.80 2cnp s GLN 49 Ca -0.08 -1.19 0.31 0.00 0.05 0.00 0.00 55.36 54.45 2cnp s GLN 49 Cb 0.12 0.50 1.49 0.00 1.10 0.00 0.00 33.01 36.21 2cnp s GLN 49 CO 0.41 -0.68 1.58 -0.44 -0.55 0.00 0.00 175.29 175.62 2cnp h ASP 50 N 2.21 0.21 -0.43 6.67 5.19 -1.91 -2.96 116.42 125.40 2cnp h ASP 50 Ca -0.25 0.17 0.05 0.00 -0.62 0.00 0.00 57.03 56.38 2cnp h ASP 50 Cb 1.25 0.17 -0.06 0.00 0.18 0.00 0.00 39.33 40.87 2cnp h ASP 50 CO 0.33 -0.28 -0.22 0.00 -3.12 0.00 0.00 179.24 175.96 2cnp n ALA 51 N -2.50 -0.18 -0.18 3.45 0.00 -1.26 -0.51 120.51 119.33 2cnp n ALA 51 Ca 0.40 0.39 -0.10 0.00 0.00 0.00 0.00 53.44 54.13 2cnp n ALA 51 Cb 1.54 -0.11 0.01 0.00 0.00 0.00 0.00 19.45 20.89 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 0.96 0.10 0.00 4.81 -1.84 0.16 114.58 118.76 2cnp h GLU 52 Ca 0.10 -0.34 -0.00 0.00 -0.13 0.00 0.00 59.36 58.99 2cnp h GLU 52 Cb 0.21 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.52 2cnp h GLU 52 CO -0.41 1.00 -0.05 0.82 -0.73 0.00 0.00 179.01 179.65 2cnp h ILE 53 N 0.82 1.04 -0.77 2.32 5.03 -1.03 -0.46 117.51 124.48 2cnp h ILE 53 Ca 0.14 -0.52 0.08 0.00 -0.12 0.00 0.00 64.86 64.44 2cnp h ILE 53 Cb 0.61 1.38 -0.07 0.00 -3.03 0.00 0.00 36.82 35.71 2cnp h ILE 53 CO 0.04 0.13 0.43 0.58 -0.68 0.00 0.00 178.15 178.65 2cnp h VAL 54 N -0.37 0.93 0.18 1.67 2.07 -0.64 -0.33 116.25 119.75 2cnp h VAL 54 Ca -0.01 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 2cnp h VAL 54 Cb 0.31 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.19 2cnp h VAL 54 CO 0.02 0.14 -0.12 0.11 0.02 0.00 0.00 177.57 177.74 2cnp h LYS 55 N 0.75 -0.28 -0.91 1.57 6.56 -0.42 0.35 116.57 124.19 2cnp h LYS 55 Ca 0.36 0.02 0.13 0.00 -1.06 0.00 0.00 60.65 60.10 2cnp h LYS 55 Cb 0.30 0.06 -0.09 0.00 -0.57 0.00 0.00 32.23 31.93 2cnp h LYS 55 CO -0.23 -0.19 0.52 -0.07 -2.06 0.00 0.00 179.45 177.43 2cnp h LEU 56 N -0.29 0.71 0.33 2.94 3.38 -0.22 0.47 115.31 122.63 2cnp h LEU 56 Ca -0.01 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2cnp h LEU 56 Cb 0.25 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2cnp h LEU 56 CO 0.01 0.34 -0.16 0.24 0.09 0.00 0.00 178.44 178.96 2cnp h MET 57 N 0.78 -0.43 -1.00 1.13 2.86 -0.86 -3.34 114.93 114.07 2cnp h MET 57 Ca 0.48 0.03 0.35 0.00 -2.06 0.00 0.00 59.70 58.49 2cnp h MET 57 Cb 0.58 0.10 -0.16 0.00 0.06 0.00 0.00 31.60 32.18 2cnp h MET 57 CO -0.31 -0.28 0.56 0.22 1.06 0.00 0.00 176.91 178.16 2cnp h ASP 58 N -0.88 0.47 -0.95 1.22 3.58 -0.09 0.44 116.42 120.21 2cnp h ASP 58 Ca -0.05 0.21 0.20 0.00 0.42 0.00 0.00 57.03 57.81 2cnp h ASP 58 Cb 0.34 0.17 -0.18 0.00 1.72 0.00 0.00 39.33 41.38 2cnp h ASP 58 CO 0.07 -0.21 -0.21 -0.67 -2.88 0.00 0.00 179.24 175.34 2cnp n ASP 59 N -5.10 -0.32 -0.03 2.28 2.03 0.14 -0.37 116.55 115.17 2cnp n ASP 59 Ca 0.33 1.63 -0.11 0.00 0.52 0.00 0.00 54.79 57.17 2cnp n ASP 59 Cb 1.07 -0.50 -0.04 0.00 -0.72 0.00 0.00 41.12 40.92 2cnp n ASP 59 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2cnp h LEU 60 N 0.00 0.19 0.38 -2.67 4.07 -1.09 0.72 115.31 116.90 2cnp h LEU 60 Ca 0.47 -0.05 -0.02 0.00 0.08 0.00 0.00 57.88 58.36 2cnp h LEU 60 Cb 0.74 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.43 2cnp h LEU 60 CO -0.97 0.18 -0.18 -0.78 -1.08 0.00 0.00 178.44 175.60 2cnp h ASP 61 N 0.18 -0.43 -0.78 -0.43 1.82 -1.18 -2.80 116.42 112.79 2cnp h ASP 61 Ca 0.06 -0.02 0.17 0.00 -0.39 0.00 0.00 57.03 56.84 2cnp h ASP 61 Cb 0.02 0.11 -0.11 0.00 0.68 0.00 0.00 39.33 40.04 2cnp h ASP 61 CO -0.01 -0.26 0.24 -0.09 -1.61 0.00 0.00 179.24 177.51 2cnp h ARG 62 N -0.58 0.31 -0.93 0.28 2.43 -0.57 0.09 114.38 115.41 2cnp h ARG 62 Ca -0.05 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2cnp h ARG 62 Cb 0.43 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 2cnp h ARG 62 CO 0.09 0.20 0.00 0.09 -1.51 0.00 0.00 179.97 178.84 2cnp n ASN 63 N -5.12 1.11 0.02 -3.80 3.02 0.23 -3.29 115.26 107.43 2cnp n ASN 63 Ca 0.16 -2.03 0.08 0.00 -0.03 0.00 0.00 54.58 52.76 2cnp n ASN 63 Cb 0.50 -0.48 0.50 0.00 -0.61 0.00 0.00 39.78 39.69 2cnp n ASN 63 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 2cnp h LYS 64 N 0.14 0.37 0.00 3.52 1.57 -0.89 0.20 116.57 121.48 2cnp h LYS 64 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2cnp h LYS 64 Cb 0.52 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2cnp h LYS 64 CO 0.02 0.24 0.00 -0.25 -0.57 0.00 0.00 179.45 178.89 2cnp n ASP 65 N -4.48 0.00 0.00 0.86 9.92 -1.21 -4.89 116.55 116.75 2cnp n ASP 65 Ca 0.05 -0.98 0.00 0.00 -0.53 0.00 0.00 54.79 53.32 2cnp n ASP 65 Cb 0.20 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.68 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 -0.59 0.00 -4.50 -1.24 3.00 0.71 -4.78 117.38 109.98 2cnp n GLN 66 Ca 0.02 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.78 2cnp n GLN 66 Cb 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 30.24 30.14 2cnp n GLN 66 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 2cnp s GLU 67 N 0.00 1.73 0.07 -1.09 2.02 -1.26 -4.19 118.70 115.98 2cnp s GLU 67 Ca 0.00 -1.95 0.04 0.00 0.02 0.00 0.00 54.97 53.08 2cnp s GLU 67 Cb 0.00 -1.16 -0.03 0.00 0.10 0.00 0.00 34.13 33.04 2cnp s GLU 67 CO 0.00 -0.10 -0.12 0.14 0.02 0.00 0.00 175.26 175.20 2cnp s VAL 68 N -3.06 0.99 0.63 2.63 -7.23 0.54 -4.88 120.40 110.02 2cnp s VAL 68 Ca 0.35 -1.34 -0.02 0.00 -1.81 0.00 0.00 61.98 59.16 2cnp s VAL 68 Cb 0.08 -1.05 0.06 0.00 0.56 0.00 0.00 36.38 36.02 2cnp s VAL 68 CO 0.16 -0.32 0.89 0.54 -0.31 0.00 0.00 175.10 176.05 2cnp s ASN 69 N -1.86 4.99 0.07 4.85 2.20 -1.26 -1.35 114.94 122.57 2cnp s ASN 69 Ca -0.02 0.11 -0.14 0.00 -0.94 0.00 0.00 52.86 51.87 2cnp s ASN 69 Cb -0.09 -0.85 -0.03 0.00 -2.00 0.00 0.00 41.25 38.29 2cnp s ASN 69 CO 0.02 -1.40 0.96 0.33 -2.94 0.00 0.00 177.10 174.07 2cnp n PHE 70 N -2.61 -0.20 0.11 1.54 7.35 -1.00 -0.85 117.46 121.80 2cnp n PHE 70 Ca 0.09 0.55 0.03 0.00 -0.76 0.00 0.00 57.45 57.36 2cnp n PHE 70 Cb 0.60 -0.48 0.41 0.00 0.35 0.00 0.00 39.48 40.36 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 0.28 -0.42 -4.13 5.75 -1.95 0.15 115.11 114.79 2cnp h GLN 71 Ca 0.07 -0.05 -0.12 0.00 -0.15 0.00 0.00 58.65 58.40 2cnp h GLN 71 Cb 0.18 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 2cnp h GLN 71 CO -0.42 0.35 -0.21 0.93 -2.65 0.00 0.00 178.83 176.83 2cnp h GLU 72 N 0.27 0.88 -0.13 1.69 5.08 -1.53 0.32 114.58 121.16 2cnp h GLU 72 Ca 0.06 -0.39 0.03 0.00 -1.00 0.00 0.00 59.36 58.06 2cnp h GLU 72 Cb 0.27 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 2cnp h GLU 72 CO 0.01 1.04 -0.07 -0.92 -1.00 0.00 0.00 179.01 178.07 2cnp h TYR 73 N 0.70 -0.16 -0.90 4.33 3.20 0.16 0.16 116.97 124.47 2cnp h TYR 73 Ca 0.09 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.07 2cnp h TYR 73 Cb 0.78 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 39.08 2cnp h TYR 73 CO 0.06 -0.11 0.58 0.82 -1.64 0.00 0.00 178.16 177.87 2cnp h ILE 74 N -0.06 0.99 -0.49 1.81 1.08 -0.50 -0.45 117.51 119.89 2cnp h ILE 74 Ca 0.07 -0.32 -0.10 0.00 -0.39 0.00 0.00 64.86 64.13 2cnp h ILE 74 Cb 0.17 -0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 33.88 2cnp h ILE 74 CO -0.16 0.17 -0.10 0.74 -0.69 0.00 0.00 178.15 178.11 2cnp h THR 75 N 0.93 1.26 0.08 -0.27 2.02 0.44 0.37 112.91 117.73 2cnp h THR 75 Ca 0.41 -1.20 0.02 0.00 0.77 0.00 0.00 66.41 66.42 2cnp h THR 75 Cb 0.36 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 67.72 2cnp h THR 75 CO -0.17 0.42 -0.27 0.15 0.37 0.00 0.00 175.52 176.02 2cnp h PHE 76 N 0.80 -0.72 -0.92 3.16 3.57 0.84 0.17 116.94 123.83 2cnp h PHE 76 Ca 0.13 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.66 2cnp h PHE 76 Cb 0.61 0.31 -0.05 0.00 2.79 0.00 0.00 35.95 39.61 2cnp h PHE 76 CO 0.04 -0.37 0.61 -0.07 -2.23 0.00 0.00 178.31 176.29 2cnp h LEU 77 N -0.46 1.05 -0.24 0.59 3.38 -1.00 -0.53 115.31 118.11 2cnp h LEU 77 Ca 0.04 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2cnp h LEU 77 Cb 0.50 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2cnp h LEU 77 CO -0.18 0.76 0.10 1.23 0.09 0.00 0.00 178.44 180.44 2cnp h GLY 78 N 1.24 0.38 0.88 0.83 0.00 0.22 0.92 103.07 107.55 2cnp h GLY 78 Ca 0.34 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 47.41 2cnp h GLY 78 CO -0.07 0.19 -0.01 0.00 0.00 0.00 0.00 176.54 176.65 2cnp h ALA 79 N 0.95 0.39 -0.10 3.60 0.00 -0.56 0.76 119.26 124.30 2cnp h ALA 79 Ca 0.08 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.79 2cnp h ALA 79 Cb 0.17 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 2cnp h ALA 79 CO -0.01 0.15 -0.49 1.25 0.00 0.00 0.00 179.25 180.15 2cnp h LEU 80 N 0.31 -1.53 -0.20 0.00 5.85 -0.92 0.80 115.31 119.62 2cnp h LEU 80 Ca 0.08 0.19 0.04 0.00 0.84 0.00 0.00 57.88 59.03 2cnp h LEU 80 Cb 0.44 0.60 -0.07 0.00 0.37 0.00 0.00 40.66 42.00 2cnp h LEU 80 CO 0.02 -0.47 -0.49 0.00 -0.34 0.00 0.00 178.44 177.16 2cnp h ALA 81 N -0.14 -0.72 -0.04 1.25 0.00 -0.72 -1.53 119.26 117.37 2cnp h ALA 81 Ca 0.05 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.97 2cnp h ALA 81 Cb 0.67 0.93 -0.06 0.00 0.00 0.00 0.00 17.79 19.33 2cnp h ALA 81 CO -0.40 -1.00 -0.43 1.98 0.00 0.00 0.00 179.25 179.39 2cnp h MET 82 N -0.50 -0.54 -0.79 0.00 1.85 -0.41 0.39 114.93 114.92 2cnp h MET 82 Ca 0.07 0.04 -0.01 0.00 -0.61 0.00 0.00 59.70 59.18 2cnp h MET 82 Cb 0.65 0.12 -0.04 0.00 0.43 0.00 0.00 31.60 32.76 2cnp h MET 82 CO -0.46 -0.36 0.46 0.82 -0.40 0.00 0.00 176.91 176.97 2cnp h ILE 83 N -0.56 1.22 -0.50 1.77 2.04 -0.60 -2.08 117.51 118.82 2cnp h ILE 83 Ca 0.05 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.39 2cnp h ILE 83 Cb 0.65 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 2cnp h ILE 83 CO -0.34 0.24 0.00 0.00 0.00 0.00 0.00 178.15 178.05 2cnp n TYR 84 N -4.37 0.65 -3.86 1.37 0.18 -0.60 -4.61 117.16 105.92 2cnp n TYR 84 Ca 0.08 -0.33 -0.29 0.00 1.88 0.00 0.00 57.90 59.24 2cnp n TYR 84 Cb 0.08 0.00 -0.13 0.00 -0.38 0.00 0.00 39.34 38.91 2cnp n TYR 84 CO 0.00 0.00 0.00 -0.80 -2.08 0.00 0.00 176.86 173.98 2cnp s ASN 85 N -1.24 4.16 0.32 9.48 0.01 0.13 -4.90 114.94 122.91 2cnp s ASN 85 Ca 0.40 -3.09 0.13 0.00 -0.71 0.00 0.00 52.86 49.59 2cnp s ASN 85 Cb 0.22 -1.45 1.05 0.00 0.41 0.00 0.00 41.25 41.47 2cnp s ASN 85 CO 0.29 -0.21 1.46 -0.62 -1.51 0.00 0.00 177.10 176.51 2cnp n GLU 86 N 2.97 -0.06 -0.28 -0.60 4.71 -1.26 -0.33 120.64 125.80 2cnp n GLU 86 Ca 0.10 1.31 0.08 0.00 -0.01 0.00 0.00 57.16 58.65 2cnp n GLU 86 Cb 0.34 -2.26 0.21 0.00 -1.01 0.00 0.00 31.44 28.72 2cnp n GLU 86 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2cnp h ALA 87 N 1.85 0.99 0.00 0.62 0.00 -1.94 0.13 119.26 120.91 2cnp h ALA 87 Ca 0.70 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.85 2cnp h ALA 87 Cb 1.74 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.91 2cnp h ALA 87 CO -0.77 -0.44 0.00 1.28 0.00 0.00 0.00 179.25 179.32 2cnp n LEU 88 N -5.30 0.00 -0.26 0.00 4.77 0.55 -0.97 117.00 115.79 2cnp n LEU 88 Ca 0.17 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.18 2cnp n LEU 88 Cb 0.56 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.72 2cnp n LEU 88 CO 0.05 0.00 0.56 0.29 -1.33 0.00 0.00 177.39 176.96 2cnp n LYS 89 N -0.80 2.86 0.00 3.23 5.02 0.43 -4.96 118.16 123.95 2cnp n LYS 89 Ca 0.10 -1.80 0.00 0.00 -2.02 0.00 0.00 58.31 54.59 2cnp n LYS 89 Cb 0.04 -1.15 0.00 0.00 -0.02 0.00 0.00 35.03 33.91 2cnp n LYS 89 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29