#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 4.50 -0.59 -5.12 0.00 -1.26 -4.82 120.51 113.22 2cnp n ALA 2 Ca 0.00 -3.78 -0.29 0.00 0.00 0.00 0.00 53.44 49.38 2cnp n ALA 2 Cb 0.00 -3.57 0.24 0.00 0.00 0.00 0.00 19.45 16.12 2cnp n ALA 2 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2cnp s SER 3 N 3.86 1.32 0.25 0.00 1.04 -1.26 -4.60 113.70 114.31 2cnp s SER 3 Ca 0.51 1.62 -0.04 0.00 0.48 0.00 0.00 55.95 58.52 2cnp s SER 3 Cb 0.10 -2.33 0.49 0.00 0.10 0.00 0.00 66.02 64.38 2cnp s SER 3 CO -0.00 -4.01 1.70 1.55 0.98 0.00 0.00 173.24 173.46 2cnp h PRO 4 N -2.49 0.32 0.20 4.02 0.13 -1.99 0.11 132.00 132.30 2cnp h PRO 4 Ca -0.58 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 64.54 2cnp h PRO 4 Cb 1.32 -0.07 -0.04 0.00 0.13 0.00 0.00 31.00 32.34 2cnp h PRO 4 CO 0.49 0.21 -0.40 -0.07 -0.23 0.00 0.00 178.00 178.00 2cnp h LEU 5 N 0.33 -1.16 -0.82 1.56 3.38 -1.97 0.64 115.31 117.26 2cnp h LEU 5 Ca 0.43 0.12 0.07 0.00 0.09 0.00 0.00 57.88 58.59 2cnp h LEU 5 Cb 0.73 0.42 -0.06 0.00 0.09 0.00 0.00 40.66 41.84 2cnp h LEU 5 CO -0.49 -0.50 0.50 -0.78 0.09 0.00 0.00 178.44 177.26 2cnp h ASP 6 N -0.69 0.76 0.06 -0.43 3.58 -1.45 0.22 116.42 118.46 2cnp h ASP 6 Ca 0.01 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 2cnp h ASP 6 Cb 0.69 -0.13 -0.00 0.00 1.72 0.00 0.00 39.33 41.60 2cnp h ASP 6 CO -0.19 0.48 -0.04 -0.61 -2.88 0.00 0.00 179.24 176.01 2cnp h GLN 7 N 0.90 -0.09 -0.28 0.28 4.15 -0.70 0.18 115.11 119.55 2cnp h GLN 7 Ca 0.36 0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.76 2cnp h GLN 7 Cb 0.20 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 2cnp h GLN 7 CO -0.18 -0.06 0.05 0.00 -1.93 0.00 0.00 178.83 176.71 2cnp h ALA 8 N 0.84 0.37 -0.26 3.38 0.00 0.06 0.23 119.26 123.88 2cnp h ALA 8 Ca -0.00 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.78 2cnp h ALA 8 Cb 0.08 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 2cnp h ALA 8 CO 0.00 0.05 -0.13 0.82 0.00 0.00 0.00 179.25 180.00 2cnp h ILE 9 N 0.28 0.60 -0.68 0.00 2.04 -0.62 -0.61 117.51 118.52 2cnp h ILE 9 Ca 0.09 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.09 2cnp h ILE 9 Cb 0.32 0.60 -0.12 0.00 -0.74 0.00 0.00 36.82 36.88 2cnp h ILE 9 CO 0.00 0.00 -0.09 1.23 0.00 0.00 0.00 178.15 179.29 2cnp h GLY 10 N -0.09 0.61 0.69 5.37 0.00 0.08 0.14 103.07 109.87 2cnp h GLY 10 Ca 0.14 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.63 2cnp h GLY 10 CO -0.32 -0.26 -0.28 1.41 0.00 0.00 0.00 176.54 177.10 2cnp h LEU 11 N 0.05 -0.75 -0.69 3.11 3.38 0.28 0.20 115.31 120.89 2cnp h LEU 11 Ca 0.35 0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.43 2cnp h LEU 11 Cb 0.56 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.52 2cnp h LEU 11 CO -0.65 -0.40 0.41 -0.07 0.09 0.00 0.00 178.44 177.81 2cnp h LEU 12 N -0.59 0.63 0.21 1.67 4.07 -0.11 0.11 115.31 121.30 2cnp h LEU 12 Ca -0.01 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.97 2cnp h LEU 12 Cb 0.55 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 2cnp h LEU 12 CO -0.06 0.42 -0.17 0.40 -1.08 0.00 0.00 178.44 177.95 2cnp h ILE 13 N 0.77 0.63 -0.21 1.22 2.04 -0.64 -0.48 117.51 120.85 2cnp h ILE 13 Ca 0.30 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.19 2cnp h ILE 13 Cb 0.12 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.80 2cnp h ILE 13 CO -0.15 0.00 -0.02 1.23 0.00 0.00 0.00 178.15 179.21 2cnp h GLY 14 N -0.39 0.18 0.33 5.37 0.00 0.09 0.17 103.07 108.83 2cnp h GLY 14 Ca -0.01 0.04 0.08 0.00 0.00 0.00 0.00 47.33 47.44 2cnp h GLY 14 CO -0.02 -0.06 0.02 -2.22 0.00 0.00 0.00 176.54 174.27 2cnp h ILE 15 N 0.04 0.69 0.55 2.60 1.08 -0.75 0.12 117.51 121.84 2cnp h ILE 15 Ca 0.10 -0.05 -0.02 0.00 -0.39 0.00 0.00 64.86 64.50 2cnp h ILE 15 Cb 0.14 0.55 -0.01 0.00 -3.07 0.00 0.00 36.82 34.42 2cnp h ILE 15 CO -0.19 0.02 -0.45 0.15 -0.69 0.00 0.00 178.15 177.00 2cnp h PHE 16 N 0.13 -1.24 -1.00 1.37 3.57 -0.05 -3.06 116.94 116.66 2cnp h PHE 16 Ca 0.21 0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.91 2cnp h PHE 16 Cb 0.30 0.47 -0.11 0.00 2.79 0.00 0.00 35.95 39.40 2cnp h PHE 16 CO -0.27 -0.63 0.61 1.25 -2.23 0.00 0.00 178.31 177.05 2cnp h HIS 17 N -0.98 1.04 -0.97 0.41 2.76 -0.32 0.19 115.15 117.28 2cnp h HIS 17 Ca -0.07 0.03 0.22 0.00 -2.20 0.00 0.00 60.37 58.35 2cnp h HIS 17 Cb 0.82 -0.31 -0.08 0.00 1.55 0.00 0.00 27.41 29.39 2cnp h HIS 17 CO -0.18 0.22 0.63 -0.22 -1.30 0.00 0.00 177.93 177.08 2cnp h LYS 18 N 0.73 0.45 0.00 5.26 3.64 -0.66 0.13 116.57 126.12 2cnp h LYS 18 Ca 0.58 -0.03 -0.25 0.00 -1.27 0.00 0.00 60.65 59.68 2cnp h LYS 18 Cb 0.94 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.62 2cnp h LYS 18 CO -0.38 0.30 -1.95 0.66 -2.27 0.00 0.00 179.45 175.81 2cnp n TYR 19 N -4.58 0.00 0.02 1.91 4.02 -0.07 -4.64 117.16 113.82 2cnp n TYR 19 Ca 0.22 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.97 2cnp n TYR 19 Cb 0.74 -0.65 -0.03 0.00 -0.02 0.00 0.00 39.34 39.38 2cnp n TYR 19 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2cnp h SER 20 N 0.00 0.70 0.00 7.72 4.64 -0.69 -3.40 113.55 122.52 2cnp h SER 20 Ca -0.37 -0.48 -0.53 0.00 -0.47 0.00 0.00 61.79 59.94 2cnp h SER 20 Cb 1.62 -0.21 0.03 0.00 -0.31 0.00 0.00 62.40 63.53 2cnp h SER 20 CO -0.04 1.25 2.63 0.61 -0.87 0.00 0.00 176.83 180.41 2cnp n GLY 21 N 0.69 3.11 0.00 -0.77 0.00 0.44 -0.97 105.19 107.69 2cnp n GLY 21 Ca -0.06 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.84 2cnp n GLY 21 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2cnp n LYS 22 N 5.37 0.00 -0.73 1.61 2.85 -1.26 -4.95 118.16 121.06 2cnp n LYS 22 Ca 0.49 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.68 2cnp n LYS 22 Cb 0.26 0.00 -0.10 0.00 -0.65 0.00 0.00 35.03 34.54 2cnp n LYS 22 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2cnp n GLU 23 N 0.00 1.46 0.00 -1.58 1.02 -0.14 -4.86 120.64 116.54 2cnp n GLU 23 Ca 0.00 -0.61 0.00 0.00 -0.02 0.00 0.00 57.16 56.53 2cnp n GLU 23 Cb 0.00 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 2cnp n GLU 23 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2cnp n GLY 24 N 2.29 0.48 3.55 0.62 0.00 -1.26 -4.48 105.19 106.39 2cnp n GLY 24 Ca 0.26 0.73 -0.41 0.00 0.00 0.00 0.00 46.02 46.61 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 -4.00 6.33 0.01 1.61 2.15 -1.26 -4.86 116.67 116.64 2cnp s ASP 25 Ca 0.00 -0.94 0.11 0.00 0.43 0.00 0.00 52.55 52.15 2cnp s ASP 25 Cb 0.00 -2.56 0.49 0.00 -0.30 0.00 0.00 42.92 40.54 2cnp s ASP 25 CO 0.00 -1.68 1.36 0.29 -0.17 0.00 0.00 175.17 174.98 2cnp n LYS 26 N 9.13 0.00 0.03 4.34 5.02 -1.26 -0.74 118.16 134.68 2cnp n LYS 26 Ca 0.18 0.31 0.13 0.00 -2.02 0.00 0.00 58.31 56.91 2cnp n LYS 26 Cb 0.50 -1.51 0.52 0.00 -0.02 0.00 0.00 35.03 34.52 2cnp n LYS 26 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2cnp n HIS 27 N -1.52 0.22 -4.38 2.13 -0.00 -1.26 -4.47 115.22 105.95 2cnp n HIS 27 Ca 0.03 0.07 -0.23 0.00 0.46 0.00 0.00 57.72 58.05 2cnp n HIS 27 Cb 0.13 -0.61 -0.11 0.00 -0.12 0.00 0.00 29.99 29.28 2cnp n HIS 27 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 2cnp s THR 28 N -3.04 2.06 0.13 3.57 -4.23 0.08 -1.11 115.64 113.10 2cnp s THR 28 Ca 0.12 -2.08 -0.12 0.00 -1.18 0.00 0.00 61.69 58.43 2cnp s THR 28 Cb 0.16 -2.02 0.01 0.00 1.34 0.00 0.00 72.50 71.99 2cnp s THR 28 CO 0.49 -0.33 0.31 -1.48 -0.54 0.00 0.00 174.62 173.08 2cnp s LEU 29 N -2.92 0.85 0.57 4.79 0.05 -0.32 -4.65 118.68 117.05 2cnp s LEU 29 Ca 0.21 -0.57 -0.05 0.00 0.05 0.00 0.00 54.13 53.77 2cnp s LEU 29 Cb -0.05 1.45 0.01 0.00 -2.05 0.00 0.00 46.19 45.54 2cnp s LEU 29 CO 0.09 -0.84 0.87 -0.94 -0.55 0.00 0.00 176.35 174.99 2cnp s SER 30 N -2.87 5.62 0.21 1.48 1.04 -1.26 -0.78 113.70 117.14 2cnp s SER 30 Ca 0.07 0.66 -0.19 0.00 0.48 0.00 0.00 55.95 56.98 2cnp s SER 30 Cb 0.03 -1.69 0.19 0.00 0.10 0.00 0.00 66.02 64.65 2cnp s SER 30 CO -0.08 -1.02 1.57 0.50 0.98 0.00 0.00 173.24 175.18 2cnp h LYS 31 N -0.11 -0.07 0.29 4.02 3.64 -1.24 0.15 116.57 123.25 2cnp h LYS 31 Ca -0.45 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 58.93 2cnp h LYS 31 Cb 1.26 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 2cnp h LYS 31 CO 0.60 -0.05 -0.23 -0.22 -2.27 0.00 0.00 179.45 177.29 2cnp h LYS 32 N -0.07 -0.51 -0.42 1.90 3.64 -1.95 -0.85 116.57 118.31 2cnp h LYS 32 Ca 0.29 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 2cnp h LYS 32 Cb 0.58 0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2cnp h LYS 32 CO -0.85 -0.34 0.27 0.93 -2.27 0.00 0.00 179.45 177.19 2cnp h GLU 33 N -0.53 0.56 0.20 1.90 3.07 -1.67 0.13 114.58 118.24 2cnp h GLU 33 Ca -0.02 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 2cnp h GLU 33 Cb 0.46 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 2cnp h GLU 33 CO -0.01 0.37 -0.10 -0.07 -1.40 0.00 0.00 179.01 177.81 2cnp h LEU 34 N 0.57 -0.23 -1.38 1.33 3.38 -0.45 0.17 115.31 118.70 2cnp h LEU 34 Ca 0.15 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2cnp h LEU 34 Cb -0.05 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2cnp h LEU 34 CO -0.03 0.08 0.36 0.11 0.09 0.00 0.00 178.44 179.05 2cnp h LYS 35 N -0.55 0.78 0.13 1.13 1.57 -0.60 -1.01 116.57 118.03 2cnp h LYS 35 Ca -0.03 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2cnp h LYS 35 Cb 0.41 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2cnp h LYS 35 CO 0.04 0.54 -0.06 0.93 -0.57 0.00 0.00 179.45 180.33 2cnp h GLU 36 N 0.80 -0.17 -0.52 3.15 5.08 -0.73 -3.10 114.58 119.08 2cnp h GLU 36 Ca 0.21 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.63 2cnp h GLU 36 Cb -0.05 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.18 2cnp h GLU 36 CO -0.04 -0.11 -0.31 1.28 -1.00 0.00 0.00 179.01 178.83 2cnp n LEU 37 N -2.47 -0.56 0.07 1.33 4.77 0.58 -0.18 117.00 120.54 2cnp n LEU 37 Ca -0.02 1.04 -0.12 0.00 -0.03 0.00 0.00 56.01 56.88 2cnp n LEU 37 Cb 0.07 -0.17 -0.05 0.00 -2.33 0.00 0.00 43.42 40.93 2cnp n LEU 37 CO 0.05 -0.81 0.77 -0.29 -1.33 0.00 0.00 177.39 175.78 2cnp h ILE 38 N 0.00 0.67 -0.37 -0.08 2.10 -1.32 0.74 117.51 119.25 2cnp h ILE 38 Ca 0.08 0.00 -0.03 0.00 1.08 0.00 0.00 64.86 65.99 2cnp h ILE 38 Cb 0.22 0.67 -0.02 0.00 -1.09 0.00 0.00 36.82 36.60 2cnp h ILE 38 CO -0.49 0.00 0.10 -0.61 -1.08 0.00 0.00 178.15 176.07 2cnp h GLN 39 N -0.26 0.58 0.11 2.19 4.15 -1.00 0.51 115.11 121.39 2cnp h GLN 39 Ca 0.03 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.31 2cnp h GLN 39 Cb 0.29 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.90 2cnp h GLN 39 CO -0.10 0.61 -0.05 0.87 -1.93 0.00 0.00 178.83 178.23 2cnp h LYS 40 N 0.45 -0.14 0.03 1.69 1.79 -0.37 -3.38 116.57 116.64 2cnp h LYS 40 Ca 0.12 0.01 -0.27 0.00 -2.18 0.00 0.00 60.65 58.32 2cnp h LYS 40 Cb 0.28 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.93 2cnp h LYS 40 CO -0.00 0.11 -1.48 0.39 -1.08 0.00 0.00 179.45 177.39 2cnp n GLU 41 N -5.05 0.61 -1.66 3.15 -0.58 0.24 -4.43 120.64 112.92 2cnp n GLU 41 Ca -0.08 0.49 -0.40 0.00 -0.42 0.00 0.00 57.16 56.74 2cnp n GLU 41 Cb 0.17 -1.73 -0.01 0.00 -0.57 0.00 0.00 31.44 29.30 2cnp n GLU 41 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2cnp n LEU 42 N -4.19 7.96 -3.63 -4.62 4.77 0.17 -4.76 117.00 112.70 2cnp n LEU 42 Ca -0.33 -4.46 -0.41 0.00 -0.03 0.00 0.00 56.01 50.78 2cnp n LEU 42 Cb 0.78 -1.53 -0.03 0.00 -2.33 0.00 0.00 43.42 40.31 2cnp n LEU 42 CO 0.24 1.78 2.42 0.35 -1.33 0.00 0.00 177.39 180.85 2cnp n THR 43 N 3.51 2.62 -1.06 -5.08 -2.24 -1.26 -4.80 114.28 105.98 2cnp n THR 43 Ca 0.65 -2.20 -0.14 0.00 -2.27 0.00 0.00 64.05 60.09 2cnp n THR 43 Cb 0.28 -2.44 -0.14 0.00 -2.10 0.00 0.00 70.33 65.93 2cnp n THR 43 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cnp n ILE 44 N 5.44 3.00 0.00 2.28 3.06 -1.26 -4.75 119.36 127.13 2cnp n ILE 44 Ca 0.51 -1.70 0.00 0.00 -2.50 0.00 0.00 62.75 59.07 2cnp n ILE 44 Cb 0.38 -1.91 0.00 0.00 0.54 0.00 0.00 39.64 38.65 2cnp n ILE 44 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2cnp n GLY 45 N 2.17 1.07 0.89 4.50 0.00 -1.26 -4.58 105.19 107.98 2cnp n GLY 45 Ca 0.42 -0.01 -0.02 0.00 0.00 0.00 0.00 46.02 46.40 2cnp n GLY 45 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cnp n SER 46 N 2.53 -0.53 -4.07 1.61 2.88 -1.26 -5.05 113.62 109.73 2cnp n SER 46 Ca 0.00 -1.39 -0.38 0.00 -1.33 0.00 0.00 58.87 55.77 2cnp n SER 46 Cb 0.00 0.88 -0.05 0.00 -0.75 0.00 0.00 64.21 64.30 2cnp n SER 46 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2cnp n LYS 47 N -0.13 1.87 -0.19 -1.46 4.76 -1.26 -4.80 118.16 116.95 2cnp n LYS 47 Ca -0.02 -2.30 0.00 0.00 -2.87 0.00 0.00 58.31 53.12 2cnp n LYS 47 Cb 0.14 -3.30 0.10 0.00 -1.84 0.00 0.00 35.03 30.13 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 14.62 0.02 -7.18 -0.35 3.38 -1.97 -3.44 115.31 120.38 2cnp h LEU 48 Ca 0.37 0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.37 2cnp h LEU 48 Cb 0.78 0.14 -0.19 0.00 0.09 0.00 0.00 40.66 41.48 2cnp h LEU 48 CO 1.65 0.02 0.02 -1.58 0.09 0.00 0.00 178.44 178.64 2cnp s GLN 49 N -6.11 0.92 0.01 1.13 -0.44 -1.26 -5.07 119.66 108.83 2cnp s GLN 49 Ca -0.13 0.10 -0.00 0.00 -2.50 0.00 0.00 55.36 52.83 2cnp s GLN 49 Cb 0.17 0.43 0.02 0.00 -1.64 0.00 0.00 33.01 31.99 2cnp s GLN 49 CO 0.74 -0.28 0.06 -3.47 0.50 0.00 0.00 175.29 172.84 2cnp n ASP 50 N 1.05 -0.01 -0.27 6.67 2.03 -1.26 -2.72 116.55 122.04 2cnp n ASP 50 Ca -0.20 0.06 -0.06 0.00 0.52 0.00 0.00 54.79 55.11 2cnp n ASP 50 Cb 0.57 -0.02 -0.05 0.00 -0.72 0.00 0.00 41.12 40.89 2cnp n ASP 50 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2cnp n ALA 51 N -3.83 -0.36 -0.11 -1.67 0.00 -1.26 -0.55 120.51 112.73 2cnp n ALA 51 Ca 0.01 0.57 -0.04 0.00 0.00 0.00 0.00 53.44 53.98 2cnp n ALA 51 Cb 0.02 -0.12 0.17 0.00 0.00 0.00 0.00 19.45 19.52 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 0.78 0.29 0.00 4.81 -1.84 0.75 114.58 119.37 2cnp h GLU 52 Ca 0.12 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2cnp h GLU 52 Cb 0.29 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.57 2cnp h GLU 52 CO -0.62 0.78 -0.14 0.82 -0.73 0.00 0.00 179.01 179.12 2cnp h ILE 53 N 0.74 0.74 -0.66 2.32 5.03 -1.03 -0.36 117.51 124.28 2cnp h ILE 53 Ca 0.15 -0.50 0.04 0.00 -0.12 0.00 0.00 64.86 64.42 2cnp h ILE 53 Cb 0.42 1.01 -0.05 0.00 -3.03 0.00 0.00 36.82 35.18 2cnp h ILE 53 CO 0.02 0.10 0.40 0.58 -0.68 0.00 0.00 178.15 178.56 2cnp h VAL 54 N -0.67 1.04 0.01 1.67 2.07 -0.69 -0.19 116.25 119.49 2cnp h VAL 54 Ca -0.04 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.25 2cnp h VAL 54 Cb 0.47 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 2cnp h VAL 54 CO 0.07 0.14 -0.23 0.11 0.02 0.00 0.00 177.57 177.67 2cnp h LYS 55 N 0.76 -0.36 -0.73 1.57 6.56 -0.71 0.35 116.57 124.01 2cnp h LYS 55 Ca 0.28 0.02 0.12 0.00 -1.06 0.00 0.00 60.65 60.01 2cnp h LYS 55 Cb 0.09 0.08 -0.08 0.00 -0.57 0.00 0.00 32.23 31.74 2cnp h LYS 55 CO -0.14 -0.24 0.32 -0.07 -2.06 0.00 0.00 179.45 177.27 2cnp h LEU 56 N -0.37 0.35 0.26 2.94 3.38 -0.26 0.06 115.31 121.67 2cnp h LEU 56 Ca 0.06 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2cnp h LEU 56 Cb 0.45 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2cnp h LEU 56 CO -0.20 0.17 -0.12 0.24 0.09 0.00 0.00 178.44 178.61 2cnp h MET 57 N 0.50 -0.33 -0.99 1.13 2.86 -0.60 -3.33 114.93 114.17 2cnp h MET 57 Ca 0.38 0.02 0.35 0.00 -2.06 0.00 0.00 59.70 58.40 2cnp h MET 57 Cb 0.52 0.08 -0.18 0.00 0.06 0.00 0.00 31.60 32.07 2cnp h MET 57 CO -0.35 -0.22 0.33 0.22 1.06 0.00 0.00 176.91 177.95 2cnp h ASP 58 N -0.48 0.01 -0.96 1.22 3.58 -0.14 -0.82 116.42 118.82 2cnp h ASP 58 Ca -0.04 0.26 0.24 0.00 0.42 0.00 0.00 57.03 57.92 2cnp h ASP 58 Cb 0.27 0.35 -0.18 0.00 1.72 0.00 0.00 39.33 41.49 2cnp h ASP 58 CO 0.06 -0.39 -0.07 -0.67 -2.88 0.00 0.00 179.24 175.30 2cnp n ASP 59 N -5.34 -0.19 -0.13 2.28 2.03 -0.01 -0.38 116.55 114.82 2cnp n ASP 59 Ca 0.32 1.64 -0.04 0.00 0.52 0.00 0.00 54.79 57.23 2cnp n ASP 59 Cb 1.05 -0.56 0.17 0.00 -0.72 0.00 0.00 41.12 41.06 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 0.79 0.09 -2.67 8.10 -1.34 0.69 115.31 120.97 2cnp h LEU 60 Ca 0.54 -0.16 -0.28 0.00 0.11 0.00 0.00 57.88 58.09 2cnp h LEU 60 Cb 1.04 -0.21 0.02 0.00 -0.44 0.00 0.00 40.66 41.07 2cnp h LEU 60 CO -0.93 0.81 -1.24 0.44 -4.11 0.00 0.00 178.44 173.41 2cnp h ASP 61 N 0.80 0.60 0.23 0.17 3.32 -0.87 -3.26 116.42 117.41 2cnp h ASP 61 Ca 0.17 -0.60 -0.01 0.00 0.02 0.00 0.00 57.03 56.61 2cnp h ASP 61 Cb 0.36 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.72 2cnp h ASP 61 CO 0.01 1.44 -0.11 -0.09 -1.72 0.00 0.00 179.24 178.77 2cnp h ARG 62 N 0.15 -0.30 -1.98 3.56 2.43 -0.51 -3.23 114.38 114.51 2cnp h ARG 62 Ca -0.16 0.02 -0.18 0.00 -0.81 0.00 0.00 59.98 58.85 2cnp h ARG 62 Cb 1.93 0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 31.48 2cnp h ARG 62 CO 0.22 -0.17 -0.19 0.09 -1.51 0.00 0.00 179.97 178.41 2cnp n ASN 63 N -5.20 5.44 -0.28 -3.80 3.02 0.22 -4.24 115.26 110.41 2cnp n ASN 63 Ca -0.09 -2.56 -0.03 0.00 -0.03 0.00 0.00 54.58 51.86 2cnp n ASN 63 Cb 0.16 -1.32 0.08 0.00 -0.61 0.00 0.00 39.78 38.09 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 2.47 0.96 -0.17 3.52 1.57 -1.67 0.36 116.57 123.61 2cnp h LYS 64 Ca 0.17 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2cnp h LYS 64 Cb 1.29 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.39 2cnp h LYS 64 CO 0.26 0.63 0.00 -0.25 -0.57 0.00 0.00 179.45 179.52 2cnp n ASP 65 N -4.59 0.17 0.00 0.86 9.92 -1.26 -4.89 116.55 116.75 2cnp n ASP 65 Ca 0.08 -1.61 0.00 0.00 -0.53 0.00 0.00 54.79 52.73 2cnp n ASP 65 Cb 0.06 -0.08 0.00 0.00 -0.64 0.00 0.00 41.12 40.45 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 -0.38 0.00 -4.46 -1.24 1.13 0.12 -4.85 117.38 107.70 2cnp n GLN 66 Ca 0.00 0.00 -0.23 0.00 -1.94 0.00 0.00 57.00 54.83 2cnp n GLN 66 Cb 0.04 -0.55 -0.10 0.00 0.11 0.00 0.00 30.24 29.74 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 1.63 0.16 -1.09 2.02 -1.26 -0.64 118.70 119.52 2cnp s GLU 67 Ca 0.00 -1.84 0.07 0.00 0.02 0.00 0.00 54.97 53.22 2cnp s GLU 67 Cb 0.00 -1.27 -0.04 0.00 0.10 0.00 0.00 34.13 32.92 2cnp s GLU 67 CO 0.00 0.04 -0.14 0.14 0.02 0.00 0.00 175.26 175.31 2cnp s VAL 68 N -2.94 1.52 0.69 2.63 -7.23 0.04 -4.84 120.40 110.28 2cnp s VAL 68 Ca 0.31 -1.96 -0.05 0.00 -1.81 0.00 0.00 61.98 58.47 2cnp s VAL 68 Cb 0.04 -1.79 0.07 0.00 0.56 0.00 0.00 36.38 35.26 2cnp s VAL 68 CO 0.13 -0.50 0.99 0.54 -0.31 0.00 0.00 175.10 175.95 2cnp s ASN 69 N -2.86 4.74 0.10 4.85 2.20 -1.26 -1.17 114.94 121.55 2cnp s ASN 69 Ca 0.15 0.27 -0.25 0.00 -0.94 0.00 0.00 52.86 52.10 2cnp s ASN 69 Cb -0.03 -0.90 -0.08 0.00 -2.00 0.00 0.00 41.25 38.25 2cnp s ASN 69 CO 0.04 -1.61 1.41 0.15 -2.94 0.00 0.00 177.10 174.16 2cnp h PHE 70 N -0.53 -1.33 -0.41 1.54 3.57 -1.49 0.11 116.94 118.39 2cnp h PHE 70 Ca -0.43 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.12 2cnp h PHE 70 Cb 1.30 0.64 -0.02 0.00 2.79 0.00 0.00 35.95 40.66 2cnp h PHE 70 CO 0.19 -0.35 0.18 0.37 -2.23 0.00 0.00 178.31 176.47 2cnp h GLN 71 N -0.23 0.57 -0.65 1.11 5.75 -1.96 0.15 115.11 119.84 2cnp h GLN 71 Ca 0.07 -0.07 -0.06 0.00 -0.15 0.00 0.00 58.65 58.44 2cnp h GLN 71 Cb 0.42 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.83 2cnp h GLN 71 CO -0.51 0.46 0.17 0.93 -2.65 0.00 0.00 178.83 177.22 2cnp h GLU 72 N 0.57 1.03 -0.31 1.69 5.08 -1.78 0.43 114.58 121.31 2cnp h GLU 72 Ca 0.14 -0.24 0.03 0.00 -1.00 0.00 0.00 59.36 58.29 2cnp h GLU 72 Cb 0.09 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 2cnp h GLU 72 CO -0.02 0.92 0.11 -0.92 -1.00 0.00 0.00 179.01 178.10 2cnp h TYR 73 N 0.96 0.19 0.00 4.33 3.20 0.66 0.13 116.97 126.44 2cnp h TYR 73 Ca 0.21 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.09 2cnp h TYR 73 Cb 0.35 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.57 2cnp h TYR 73 CO 0.03 0.09 -0.02 0.82 -1.64 0.00 0.00 178.16 177.44 2cnp h ILE 74 N 0.24 0.97 -0.35 1.81 1.08 -0.22 0.26 117.51 121.30 2cnp h ILE 74 Ca 0.14 -0.06 -0.15 0.00 -0.39 0.00 0.00 64.86 64.40 2cnp h ILE 74 Cb 0.10 1.03 -0.00 0.00 -3.07 0.00 0.00 36.82 34.88 2cnp h ILE 74 CO -0.14 0.02 -0.37 0.74 -0.69 0.00 0.00 178.15 177.71 2cnp h THR 75 N 0.00 1.28 0.15 -0.27 2.02 0.10 0.33 112.91 116.51 2cnp h THR 75 Ca -0.00 -1.55 0.01 0.00 0.77 0.00 0.00 66.41 65.64 2cnp h THR 75 Cb 0.03 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 2cnp h THR 75 CO 0.00 0.51 -0.21 0.15 0.37 0.00 0.00 175.52 176.34 2cnp h PHE 76 N 0.67 -0.56 -0.71 3.16 3.57 0.69 0.15 116.94 123.91 2cnp h PHE 76 Ca 0.05 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 2cnp h PHE 76 Cb 0.96 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.90 2cnp h PHE 76 CO 0.07 -0.31 0.28 -0.07 -2.23 0.00 0.00 178.31 176.05 2cnp h LEU 77 N -0.42 0.99 -0.56 0.59 3.38 -0.99 -0.61 115.31 117.69 2cnp h LEU 77 Ca 0.02 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 2cnp h LEU 77 Cb 0.42 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2cnp h LEU 77 CO -0.10 0.89 0.04 1.23 0.09 0.00 0.00 178.44 180.59 2cnp h GLY 78 N 1.02 1.04 0.96 0.83 0.00 -0.15 0.70 103.07 107.48 2cnp h GLY 78 Ca 0.24 -0.74 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 2cnp h GLY 78 CO -0.02 0.68 0.16 0.00 0.00 0.00 0.00 176.54 177.36 2cnp h ALA 79 N 0.98 0.36 0.10 3.60 0.00 -0.53 0.11 119.26 123.88 2cnp h ALA 79 Ca 0.16 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2cnp h ALA 79 Cb 0.49 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 2cnp h ALA 79 CO 0.02 -0.12 -0.46 1.25 0.00 0.00 0.00 179.25 179.94 2cnp h LEU 80 N 0.34 -1.36 -0.47 0.00 5.85 -0.78 0.87 115.31 119.75 2cnp h LEU 80 Ca 0.10 0.15 0.09 0.00 0.84 0.00 0.00 57.88 59.06 2cnp h LEU 80 Cb 0.05 0.51 -0.10 0.00 0.37 0.00 0.00 40.66 41.49 2cnp h LEU 80 CO -0.02 -0.51 -0.29 0.00 -0.34 0.00 0.00 178.44 177.28 2cnp h ALA 81 N -0.27 -0.03 0.05 1.25 0.00 -0.72 -1.58 119.26 117.96 2cnp h ALA 81 Ca 0.02 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2cnp h ALA 81 Cb 0.71 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 2cnp h ALA 81 CO -0.27 -0.65 -0.12 1.98 0.00 0.00 0.00 179.25 180.19 2cnp h MET 82 N -0.18 -0.22 -0.44 0.00 1.85 -0.35 0.21 114.93 115.80 2cnp h MET 82 Ca 0.21 0.02 -0.01 0.00 -0.61 0.00 0.00 59.70 59.30 2cnp h MET 82 Cb 0.52 0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.58 2cnp h MET 82 CO -0.58 -0.15 0.24 0.82 -0.40 0.00 0.00 176.91 176.84 2cnp h ILE 83 N -0.23 1.16 0.09 1.77 2.04 -0.23 -3.18 117.51 118.94 2cnp h ILE 83 Ca 0.03 -0.42 -0.28 0.00 1.00 0.00 0.00 64.86 65.18 2cnp h ILE 83 Cb 0.26 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2cnp h ILE 83 CO -0.08 0.17 -1.38 0.10 0.00 0.00 0.00 178.15 176.95 2cnp h TYR 84 N 0.57 0.34 -1.63 1.37 -0.00 -1.26 -3.40 116.97 112.96 2cnp h TYR 84 Ca 0.15 -0.25 -0.67 0.00 0.00 0.00 0.00 58.73 57.97 2cnp h TYR 84 Cb 0.06 -0.01 -0.13 0.00 0.00 0.00 0.00 36.73 36.65 2cnp h TYR 84 CO -0.02 1.25 1.45 -0.80 -0.00 0.00 0.00 178.16 180.05 2cnp s ASN 85 N -6.89 6.74 0.30 0.10 0.01 0.75 -4.85 114.94 111.09 2cnp s ASN 85 Ca -0.06 -2.18 0.13 0.00 -0.71 0.00 0.00 52.86 50.04 2cnp s ASN 85 Cb 0.08 -2.49 0.98 0.00 0.41 0.00 0.00 41.25 40.23 2cnp s ASN 85 CO 0.85 -1.15 1.33 -1.84 -1.51 0.00 0.00 177.10 174.79 2cnp n GLU 86 N 7.44 -0.06 0.24 -0.60 -0.00 -1.26 -0.59 120.64 125.82 2cnp n GLU 86 Ca 0.35 1.20 0.12 0.00 -0.00 0.00 0.00 57.16 58.83 2cnp n GLU 86 Cb 0.48 -2.07 0.67 0.00 -0.00 0.00 0.00 31.44 30.51 2cnp n GLU 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2cnp h ALA 87 N 1.69 1.17 -0.42 -1.84 0.00 -1.89 -0.86 119.26 117.12 2cnp h ALA 87 Ca 0.65 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.56 2cnp h ALA 87 Cb 1.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.43 2cnp h ALA 87 CO -0.70 -0.17 0.00 1.28 0.00 0.00 0.00 179.25 179.67 2cnp n LEU 88 N -2.49 3.13 -4.40 0.00 4.77 0.25 -4.92 117.00 113.34 2cnp n LEU 88 Ca -0.02 -2.01 -0.27 0.00 -0.03 0.00 0.00 56.01 53.68 2cnp n LEU 88 Cb 0.24 -0.28 -0.08 0.00 -2.33 0.00 0.00 43.42 40.97 2cnp n LEU 88 CO 0.11 0.78 1.46 0.29 -1.33 0.00 0.00 177.39 178.70 2cnp n LYS 89 N 0.70 1.10 0.00 3.23 4.76 -0.33 -4.89 118.16 122.73 2cnp n LYS 89 Ca 0.14 -2.11 0.00 0.00 -2.87 0.00 0.00 58.31 53.47 2cnp n LYS 89 Cb 0.47 -3.62 0.00 0.00 -1.84 0.00 0.00 35.03 30.04 2cnp n LYS 89 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44