#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 4.57 -0.60 3.04 0.00 -1.26 -4.93 120.51 121.32 2cnp n ALA 2 Ca 0.00 -3.67 -0.30 0.00 0.00 0.00 0.00 53.44 49.47 2cnp n ALA 2 Cb 0.00 -3.58 0.20 0.00 0.00 0.00 0.00 19.45 16.08 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 6.97 -1.42 -0.25 0.00 7.64 -1.26 -4.41 113.62 120.88 2cnp n SER 3 Ca 0.51 0.05 0.05 0.00 1.01 0.00 0.00 58.87 60.48 2cnp n SER 3 Cb 0.40 -1.25 0.16 0.00 -1.01 0.00 0.00 64.21 62.51 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 -2.24 0.12 -0.26 1.43 0.11 -1.99 0.20 132.00 129.37 2cnp h PRO 4 Ca -0.53 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.62 2cnp h PRO 4 Cb 1.32 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.35 2cnp h PRO 4 CO 0.43 0.08 -0.03 -0.07 -0.21 0.00 0.00 178.00 178.20 2cnp h LEU 5 N 0.13 -0.17 -0.79 2.35 3.38 -1.99 0.61 115.31 118.82 2cnp h LEU 5 Ca 0.40 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.43 2cnp h LEU 5 Cb 0.70 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 2cnp h LEU 5 CO -0.62 -0.05 0.44 -0.78 0.09 0.00 0.00 178.44 177.51 2cnp h ASP 6 N 0.04 0.99 0.18 -0.43 3.58 -1.02 0.17 116.42 119.92 2cnp h ASP 6 Ca 0.12 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 2cnp h ASP 6 Cb 0.18 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 40.98 2cnp h ASP 6 CO -0.24 0.80 -0.09 -0.61 -2.88 0.00 0.00 179.24 176.23 2cnp h GLN 7 N 1.10 -0.23 -0.34 0.28 4.15 -0.66 0.20 115.11 119.61 2cnp h GLN 7 Ca 0.28 0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.70 2cnp h GLN 7 Cb 0.03 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 2cnp h GLN 7 CO -0.05 -0.13 0.14 0.00 -1.93 0.00 0.00 178.83 176.86 2cnp h ALA 8 N 0.56 0.44 -0.11 3.38 0.00 -0.44 0.17 119.26 123.26 2cnp h ALA 8 Ca -0.02 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2cnp h ALA 8 Cb 0.20 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 2cnp h ALA 8 CO 0.04 0.03 -0.24 0.82 0.00 0.00 0.00 179.25 179.90 2cnp h ILE 9 N 0.40 0.43 -0.77 0.00 2.04 -0.69 -1.68 117.51 117.24 2cnp h ILE 9 Ca 0.11 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.15 2cnp h ILE 9 Cb 0.17 0.43 -0.14 0.00 -0.74 0.00 0.00 36.82 36.54 2cnp h ILE 9 CO -0.01 0.00 -0.01 1.23 0.00 0.00 0.00 178.15 179.36 2cnp h GLY 10 N -0.31 0.84 0.50 5.37 0.00 0.26 0.16 103.07 109.89 2cnp h GLY 10 Ca 0.09 0.13 0.01 0.00 0.00 0.00 0.00 47.33 47.56 2cnp h GLY 10 CO -0.29 -0.30 -0.36 1.41 0.00 0.00 0.00 176.54 177.00 2cnp h LEU 11 N 0.09 -1.00 -0.65 3.11 3.38 -0.08 0.17 115.31 120.33 2cnp h LEU 11 Ca 0.42 0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.53 2cnp h LEU 11 Cb 0.74 0.36 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 2cnp h LEU 11 CO -0.70 -0.47 0.39 -0.07 0.09 0.00 0.00 178.44 177.68 2cnp h LEU 12 N -0.66 0.62 0.25 1.67 4.07 -0.21 0.56 115.31 121.60 2cnp h LEU 12 Ca 0.00 0.01 0.01 0.00 0.08 0.00 0.00 57.88 57.98 2cnp h LEU 12 Cb 0.64 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 42.23 2cnp h LEU 12 CO -0.13 0.43 -0.33 0.40 -1.08 0.00 0.00 178.44 177.72 2cnp h ILE 13 N 0.75 0.31 -0.28 1.22 2.04 -0.61 -0.97 117.51 119.98 2cnp h ILE 13 Ca 0.27 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.18 2cnp h ILE 13 Cb 0.06 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 36.40 2cnp h ILE 13 CO -0.12 0.00 -0.04 1.23 0.00 0.00 0.00 178.15 179.22 2cnp h GLY 14 N -0.64 0.23 0.33 5.37 0.00 -0.12 0.12 103.07 108.37 2cnp h GLY 14 Ca 0.00 0.06 0.08 0.00 0.00 0.00 0.00 47.33 47.47 2cnp h GLY 14 CO -0.12 -0.08 0.02 -2.22 0.00 0.00 0.00 176.54 174.14 2cnp h ILE 15 N 0.04 0.69 0.61 2.60 1.08 -0.81 0.11 117.51 121.83 2cnp h ILE 15 Ca 0.13 -0.05 -0.02 0.00 -0.39 0.00 0.00 64.86 64.53 2cnp h ILE 15 Cb 0.19 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 34.47 2cnp h ILE 15 CO -0.26 0.02 -0.46 0.15 -0.69 0.00 0.00 178.15 176.92 2cnp h PHE 16 N 0.14 -1.25 -0.91 1.37 3.57 -0.21 -3.16 116.94 116.48 2cnp h PHE 16 Ca 0.22 -0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.86 2cnp h PHE 16 Cb 0.30 0.47 -0.07 0.00 2.79 0.00 0.00 35.95 39.44 2cnp h PHE 16 CO -0.26 -0.65 0.58 1.25 -2.23 0.00 0.00 178.31 177.00 2cnp h HIS 17 N -1.03 0.84 -0.99 0.41 2.76 -0.33 0.16 115.15 116.96 2cnp h HIS 17 Ca -0.08 0.02 0.23 0.00 -2.20 0.00 0.00 60.37 58.35 2cnp h HIS 17 Cb 0.85 -0.26 -0.09 0.00 1.55 0.00 0.00 27.41 29.46 2cnp h HIS 17 CO -0.16 0.30 0.64 -0.22 -1.30 0.00 0.00 177.93 177.18 2cnp h LYS 18 N 0.70 0.47 0.00 5.26 3.64 -0.75 0.56 116.57 126.44 2cnp h LYS 18 Ca 0.46 -0.03 -0.33 0.00 -1.27 0.00 0.00 60.65 59.49 2cnp h LYS 18 Cb 0.75 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.41 2cnp h LYS 18 CO -0.22 0.31 -2.06 0.66 -2.27 0.00 0.00 179.45 175.87 2cnp n TYR 19 N -4.63 0.00 -0.24 1.91 4.02 -0.04 -4.63 117.16 113.54 2cnp n TYR 19 Ca 0.23 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 58.14 2cnp n TYR 19 Cb 0.76 -0.79 0.24 0.00 -0.02 0.00 0.00 39.34 39.53 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 -0.89 0.88 0.00 7.72 0.02 -0.79 -3.35 113.55 117.14 2cnp h SER 20 Ca -0.49 -0.02 -0.52 0.00 -0.84 0.00 0.00 61.79 59.92 2cnp h SER 20 Cb 1.41 -0.21 0.02 0.00 0.14 0.00 0.00 62.40 63.76 2cnp h SER 20 CO -0.30 0.62 2.72 0.61 -1.14 0.00 0.00 176.83 179.35 2cnp n GLY 21 N -1.42 3.22 0.00 -3.77 0.00 0.18 -2.46 105.19 100.94 2cnp n GLY 21 Ca 0.10 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.00 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 5.09 0.00 -0.36 1.61 2.85 -1.26 -4.97 118.16 121.12 2cnp n LYS 22 Ca 0.51 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.77 2cnp n LYS 22 Cb 0.24 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.62 2cnp n LYS 22 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 2cnp n GLU 23 N -0.52 0.84 0.00 -1.58 0.28 -1.03 -4.85 120.64 113.77 2cnp n GLU 23 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2cnp n GLU 23 Cb 0.00 -1.08 0.00 0.00 1.43 0.00 0.00 31.44 31.79 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 1.45 0.70 3.47 -1.84 0.00 -1.26 -4.55 105.19 103.15 2cnp n GLY 24 Ca 0.00 0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.94 2cnp n GLY 24 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2cnp n ASP 25 N 1.79 4.56 0.00 1.61 -0.08 -1.26 -4.78 116.55 118.39 2cnp n ASP 25 Ca 0.00 -2.88 0.01 0.00 -1.51 0.00 0.00 54.79 50.40 2cnp n ASP 25 Cb 0.00 -1.73 0.02 0.00 2.34 0.00 0.00 41.12 41.76 2cnp n ASP 25 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 2cnp n LYS 26 N 8.07 0.00 0.04 -0.67 2.85 -1.26 -0.74 118.16 126.45 2cnp n LYS 26 Ca 0.49 0.48 0.13 0.00 -1.05 0.00 0.00 58.31 58.36 2cnp n LYS 26 Cb 0.45 -1.50 0.52 0.00 -0.65 0.00 0.00 35.03 33.86 2cnp n LYS 26 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 177.40 178.93 2cnp n HIS 27 N -1.50 0.31 -4.52 5.58 -0.00 -1.26 -4.52 115.22 109.31 2cnp n HIS 27 Ca 0.00 0.09 -0.25 0.00 0.46 0.00 0.00 57.72 58.03 2cnp n HIS 27 Cb 0.01 -0.65 -0.11 0.00 -0.12 0.00 0.00 29.99 29.13 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 1.93 0.17 3.57 -4.23 0.08 -0.92 115.64 113.19 2cnp s THR 28 Ca 0.12 -2.12 -0.13 0.00 -1.18 0.00 0.00 61.69 58.38 2cnp s THR 28 Cb 0.16 -2.68 0.01 0.00 1.34 0.00 0.00 72.50 71.33 2cnp s THR 28 CO 0.52 -0.17 0.40 -1.48 -0.54 0.00 0.00 174.62 173.35 2cnp s LEU 29 N -3.57 0.55 0.58 4.79 0.05 -0.25 -4.66 118.68 116.16 2cnp s LEU 29 Ca 0.33 -0.64 -0.05 0.00 0.05 0.00 0.00 54.13 53.81 2cnp s LEU 29 Cb 0.05 1.66 0.01 0.00 -2.05 0.00 0.00 46.19 45.86 2cnp s LEU 29 CO 0.15 -0.95 0.88 -0.94 -0.55 0.00 0.00 176.35 174.94 2cnp s SER 30 N -2.91 5.55 0.23 1.48 1.04 -1.26 -0.81 113.70 117.02 2cnp s SER 30 Ca 0.12 0.64 -0.08 0.00 0.48 0.00 0.00 55.95 57.10 2cnp s SER 30 Cb 0.01 -1.62 0.37 0.00 0.10 0.00 0.00 66.02 64.88 2cnp s SER 30 CO -0.03 -1.07 1.66 0.07 0.98 0.00 0.00 173.24 174.86 2cnp h LYS 31 N -0.15 0.16 0.15 4.02 2.10 -1.39 0.53 116.57 121.99 2cnp h LYS 31 Ca -0.45 -0.01 0.01 0.00 -2.00 0.00 0.00 60.65 58.20 2cnp h LYS 31 Cb 1.26 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.54 2cnp h LYS 31 CO 0.60 0.10 -0.19 -0.22 -2.00 0.00 0.00 179.45 177.75 2cnp h LYS 32 N 0.16 -0.37 -0.70 0.07 1.63 -1.94 0.28 116.57 115.69 2cnp h LYS 32 Ca 0.37 0.03 0.06 0.00 -0.85 0.00 0.00 60.65 60.25 2cnp h LYS 32 Cb 0.61 0.09 -0.06 0.00 -0.60 0.00 0.00 32.23 32.27 2cnp h LYS 32 CO -0.55 -0.25 0.40 0.93 -3.45 0.00 0.00 179.45 176.53 2cnp h GLU 33 N -0.39 0.70 0.23 1.90 5.08 -1.71 0.11 114.58 120.51 2cnp h GLU 33 Ca 0.01 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2cnp h GLU 33 Cb 0.38 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2cnp h GLU 33 CO -0.07 0.46 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.22 2cnp h LEU 34 N 0.72 -0.26 -1.19 1.33 3.38 -0.52 0.20 115.31 118.97 2cnp h LEU 34 Ca 0.32 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.32 2cnp h LEU 34 Cb 0.20 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 2cnp h LEU 34 CO -0.19 -0.17 0.56 0.11 0.09 0.00 0.00 178.44 178.84 2cnp h LYS 35 N -0.33 1.01 0.00 1.13 1.57 -0.52 -0.87 116.57 118.56 2cnp h LYS 35 Ca -0.03 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2cnp h LYS 35 Cb 0.25 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2cnp h LYS 35 CO 0.05 0.67 0.00 0.39 -0.57 0.00 0.00 179.45 179.99 2cnp n GLU 36 N -4.46 0.00 -0.25 3.15 1.02 0.36 -3.43 120.64 117.03 2cnp n GLU 36 Ca 0.12 0.48 -0.07 0.00 -0.02 0.00 0.00 57.16 57.67 2cnp n GLU 36 Cb 0.13 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 30.03 2cnp n GLU 36 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2cnp n LEU 37 N -1.94 -0.63 0.13 -4.62 4.77 0.68 -0.31 117.00 115.08 2cnp n LEU 37 Ca 0.00 1.07 -0.13 0.00 -0.03 0.00 0.00 56.01 56.92 2cnp n LEU 37 Cb 0.00 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 40.89 2cnp n LEU 37 CO 0.00 -0.87 0.71 -0.29 -1.33 0.00 0.00 177.39 175.61 2cnp h ILE 38 N 0.00 0.48 -0.42 -0.08 2.10 -1.31 0.69 117.51 118.97 2cnp h ILE 38 Ca 0.09 0.00 -0.14 0.00 1.08 0.00 0.00 64.86 65.89 2cnp h ILE 38 Cb 0.24 0.48 -0.01 0.00 -1.09 0.00 0.00 36.82 36.44 2cnp h ILE 38 CO -0.56 0.00 -0.29 -0.61 -1.08 0.00 0.00 178.15 175.61 2cnp h GLN 39 N -0.47 0.93 0.41 2.19 4.15 -1.13 0.12 115.11 121.33 2cnp h GLN 39 Ca 0.02 -0.45 -0.02 0.00 0.77 0.00 0.00 58.65 58.97 2cnp h GLN 39 Cb 0.47 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.15 2cnp h GLN 39 CO -0.10 1.11 -0.20 0.87 -1.93 0.00 0.00 178.83 178.57 2cnp h LYS 40 N 0.76 -0.54 0.00 1.69 1.79 -0.46 -3.31 116.57 116.50 2cnp h LYS 40 Ca 0.08 0.04 -0.11 0.00 -2.18 0.00 0.00 60.65 58.48 2cnp h LYS 40 Cb 0.87 0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.63 2cnp h LYS 40 CO 0.08 -0.33 -0.60 0.93 -1.08 0.00 0.00 179.45 178.44 2cnp h GLU 41 N -0.60 0.00 -4.75 3.15 4.39 -0.86 -3.34 114.58 112.56 2cnp h GLU 41 Ca -0.06 -0.00 -0.66 0.00 0.34 0.00 0.00 59.36 58.98 2cnp h GLU 41 Cb 0.45 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.06 2cnp h GLU 41 CO 0.09 1.00 2.58 1.28 -1.16 0.00 0.00 179.01 182.81 2cnp n LEU 42 N -4.52 5.62 -0.27 1.33 4.77 0.42 -4.69 117.00 119.66 2cnp n LEU 42 Ca -0.21 -3.84 0.07 0.00 -0.03 0.00 0.00 56.01 52.01 2cnp n LEU 42 Cb 0.58 -1.62 0.22 0.00 -2.33 0.00 0.00 43.42 40.26 2cnp n LEU 42 CO 0.27 0.40 1.02 0.71 -1.33 0.00 0.00 177.39 178.46 2cnp h THR 43 N 4.71 0.61 0.00 -5.08 1.35 -1.70 -3.42 112.91 109.38 2cnp h THR 43 Ca 0.49 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 66.20 2cnp h THR 43 Cb 0.74 0.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.29 2cnp h THR 43 CO 1.71 0.08 0.00 0.00 -0.25 0.00 0.00 175.52 177.06 2cnp n ILE 44 N -5.02 0.00 0.00 6.82 3.06 -1.26 -4.75 119.36 118.21 2cnp n ILE 44 Ca 0.16 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.41 2cnp n ILE 44 Cb 0.47 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.65 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 0.00 0.88 2.54 4.50 0.00 -1.26 -4.93 105.19 106.92 2cnp n GLY 45 Ca 0.00 -1.97 -0.28 0.00 0.00 0.00 0.00 46.02 43.77 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 0.58 5.97 -3.66 1.61 7.64 -1.26 -4.50 113.62 120.00 2cnp n SER 46 Ca 0.00 -2.42 -0.29 0.00 1.01 0.00 0.00 58.87 57.17 2cnp n SER 46 Cb 0.00 -1.25 0.04 0.00 -1.01 0.00 0.00 64.21 61.99 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 4.16 -1.19 -0.31 1.43 5.02 -1.26 -4.84 118.16 121.17 2cnp n LYS 47 Ca 0.55 0.54 0.16 0.00 -2.02 0.00 0.00 58.31 57.54 2cnp n LYS 47 Cb 0.18 -3.98 0.34 0.00 -0.02 0.00 0.00 35.03 31.54 2cnp n LYS 47 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2cnp h LEU 48 N -1.60 0.06 -7.46 -0.35 3.38 -1.92 -3.43 115.31 103.99 2cnp h LEU 48 Ca -0.61 0.21 -0.16 0.00 0.09 0.00 0.00 57.88 57.41 2cnp h LEU 48 Cb 1.34 0.26 -0.25 0.00 0.09 0.00 0.00 40.66 42.10 2cnp h LEU 48 CO 0.46 -0.19 -0.40 -1.58 0.09 0.00 0.00 178.44 176.82 2cnp s GLN 49 N -5.87 0.32 0.27 1.13 0.74 -1.26 -5.07 119.66 109.93 2cnp s GLN 49 Ca -0.12 0.36 0.06 0.00 0.05 0.00 0.00 55.36 55.71 2cnp s GLN 49 Cb 0.27 0.16 0.77 0.00 1.10 0.00 0.00 33.01 35.31 2cnp s GLN 49 CO 0.78 -0.04 1.31 -0.25 -0.55 0.00 0.00 175.29 176.53 2cnp n ASP 50 N 2.89 0.01 -0.31 6.67 9.92 -1.26 -1.86 116.55 132.60 2cnp n ASP 50 Ca -0.13 1.41 0.03 0.00 -0.53 0.00 0.00 54.79 55.57 2cnp n ASP 50 Cb 0.58 -0.56 0.09 0.00 -0.64 0.00 0.00 41.12 40.59 2cnp n ASP 50 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cnp n ALA 51 N -3.00 0.12 -0.19 2.24 0.00 -1.26 -0.51 120.51 117.90 2cnp n ALA 51 Ca 0.23 0.90 -0.08 0.00 0.00 0.00 0.00 53.44 54.49 2cnp n ALA 51 Cb 0.76 -0.51 0.06 0.00 0.00 0.00 0.00 19.45 19.76 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 1.02 0.15 0.00 4.81 -1.71 0.14 114.58 118.99 2cnp h GLU 52 Ca 0.37 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2cnp h GLU 52 Cb 0.58 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.87 2cnp h GLU 52 CO -0.86 1.00 -0.07 0.82 -0.73 0.00 0.00 179.01 179.17 2cnp h ILE 53 N 0.94 0.97 -0.66 2.32 5.03 -0.98 -0.33 117.51 124.81 2cnp h ILE 53 Ca 0.17 -0.56 0.06 0.00 -0.12 0.00 0.00 64.86 64.41 2cnp h ILE 53 Cb 0.54 1.32 -0.05 0.00 -3.03 0.00 0.00 36.82 35.59 2cnp h ILE 53 CO 0.03 0.13 0.36 0.58 -0.68 0.00 0.00 178.15 178.57 2cnp h VAL 54 N -0.47 0.96 0.13 1.67 2.07 -0.67 0.27 116.25 120.21 2cnp h VAL 54 Ca -0.02 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.28 2cnp h VAL 54 Cb 0.37 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 2cnp h VAL 54 CO 0.03 0.12 -0.20 0.11 0.02 0.00 0.00 177.57 177.65 2cnp h LYS 55 N 0.67 -0.38 -0.72 1.57 6.56 -0.56 0.18 116.57 123.89 2cnp h LYS 55 Ca 0.30 0.03 0.12 0.00 -1.06 0.00 0.00 60.65 60.03 2cnp h LYS 55 Cb 0.19 0.09 -0.08 0.00 -0.57 0.00 0.00 32.23 31.85 2cnp h LYS 55 CO -0.18 -0.25 0.32 -0.07 -2.06 0.00 0.00 179.45 177.20 2cnp h LEU 56 N -0.39 0.36 0.60 2.94 3.38 -0.14 0.14 115.31 122.20 2cnp h LEU 56 Ca 0.02 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2cnp h LEU 56 Cb 0.41 0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.20 2cnp h LEU 56 CO -0.10 0.18 -0.29 0.24 0.09 0.00 0.00 178.44 178.56 2cnp h MET 57 N 0.51 -0.78 -0.56 1.13 2.86 -0.66 -3.27 114.93 114.17 2cnp h MET 57 Ca 0.38 0.05 0.10 0.00 -2.06 0.00 0.00 59.70 58.17 2cnp h MET 57 Cb 0.49 0.18 -0.03 0.00 0.06 0.00 0.00 31.60 32.29 2cnp h MET 57 CO -0.33 -0.47 0.38 0.22 1.06 0.00 0.00 176.91 177.77 2cnp h ASP 58 N -1.05 0.30 -0.93 1.22 3.58 -0.26 -3.07 116.42 116.20 2cnp h ASP 58 Ca -0.08 0.01 0.23 0.00 0.42 0.00 0.00 57.03 57.61 2cnp h ASP 58 Cb 0.67 -0.05 -0.17 0.00 1.72 0.00 0.00 39.33 41.49 2cnp h ASP 58 CO 0.14 0.18 -0.06 -0.67 -2.88 0.00 0.00 179.24 175.94 2cnp n ASP 59 N -4.46 -0.18 -0.10 2.28 2.03 0.46 -0.30 116.55 116.28 2cnp n ASP 59 Ca 0.09 1.59 -0.06 0.00 0.52 0.00 0.00 54.79 56.93 2cnp n ASP 59 Cb 0.39 -0.55 0.01 0.00 -0.72 0.00 0.00 41.12 40.26 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 0.00 -0.25 -2.67 -0.00 -1.75 0.96 115.31 111.60 2cnp h LEU 60 Ca 0.53 0.06 -0.06 0.00 -0.00 0.00 0.00 57.88 58.41 2cnp h LEU 60 Cb 1.01 0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.74 2cnp h LEU 60 CO -0.90 0.04 -0.07 -0.78 -0.00 0.00 0.00 178.44 176.73 2cnp h ASP 61 N 0.18 0.49 -0.77 -0.43 3.58 -0.88 0.11 116.42 118.70 2cnp h ASP 61 Ca 0.16 -0.37 0.12 0.00 0.42 0.00 0.00 57.03 57.35 2cnp h ASP 61 Cb 0.18 -0.13 -0.08 0.00 1.72 0.00 0.00 39.33 41.02 2cnp h ASP 61 CO -0.22 0.75 0.38 -0.09 -2.88 0.00 0.00 179.24 177.18 2cnp h ARG 62 N 0.22 0.58 -0.00 0.28 2.43 -0.27 0.14 114.38 117.75 2cnp h ARG 62 Ca 0.06 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2cnp h ARG 62 Cb 0.54 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2cnp h ARG 62 CO 0.03 0.39 -0.13 0.09 -1.51 0.00 0.00 179.97 178.83 2cnp n ASN 63 N -4.88 0.45 -4.10 -3.80 3.02 0.28 -4.87 115.26 101.36 2cnp n ASN 63 Ca 0.14 -0.48 -0.29 0.00 -0.03 0.00 0.00 54.58 53.92 2cnp n ASN 63 Cb 0.34 -0.08 -0.05 0.00 -0.61 0.00 0.00 39.78 39.39 2cnp n ASN 63 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2cnp n LYS 64 N -1.03 -2.55 -2.12 3.52 5.02 0.48 -0.39 118.16 121.08 2cnp n LYS 64 Ca 0.13 0.31 -0.18 0.00 -2.02 0.00 0.00 58.31 56.55 2cnp n LYS 64 Cb 0.29 -4.33 -0.03 0.00 -0.02 0.00 0.00 35.03 30.94 2cnp n LYS 64 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2cnp n ASP 65 N -2.91 -5.02 0.00 4.39 8.00 0.29 -4.82 116.55 116.47 2cnp n ASP 65 Ca -0.26 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.42 2cnp n ASP 65 Cb 0.66 -4.30 0.00 0.00 -0.02 0.00 0.00 41.12 37.46 2cnp n ASP 65 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cnp n GLN 66 N -2.69 0.00 -4.26 -1.24 6.02 0.47 -4.97 117.38 110.71 2cnp n GLN 66 Ca -0.20 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.65 2cnp n GLN 66 Cb 0.64 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.79 2cnp n GLN 66 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2cnp s GLU 67 N 1.07 1.21 0.07 -1.09 8.01 -1.07 -0.94 118.70 125.96 2cnp s GLU 67 Ca 0.00 -1.62 0.01 0.00 0.01 0.00 0.00 54.97 53.37 2cnp s GLU 67 Cb 0.00 -0.17 -0.03 0.00 -4.31 0.00 0.00 34.13 29.61 2cnp s GLU 67 CO 0.00 -0.23 -0.06 0.14 0.01 0.00 0.00 175.26 175.13 2cnp s VAL 68 N -3.77 0.51 0.61 2.63 -7.23 0.01 -4.53 120.40 108.63 2cnp s VAL 68 Ca 0.30 -1.58 -0.03 0.00 -1.81 0.00 0.00 61.98 58.86 2cnp s VAL 68 Cb 0.07 -1.22 0.04 0.00 0.56 0.00 0.00 36.38 35.82 2cnp s VAL 68 CO 0.08 -0.73 0.89 0.54 -0.31 0.00 0.00 175.10 175.57 2cnp s ASN 69 N -2.47 5.19 0.11 4.85 2.20 -1.26 -1.09 114.94 122.47 2cnp s ASN 69 Ca 0.02 0.35 -0.21 0.00 -0.94 0.00 0.00 52.86 52.08 2cnp s ASN 69 Cb 0.00 -1.19 -0.05 0.00 -2.00 0.00 0.00 41.25 38.02 2cnp s ASN 69 CO -0.04 -1.28 1.19 0.33 -2.94 0.00 0.00 177.10 174.36 2cnp n PHE 70 N -2.61 -0.29 0.01 1.54 7.35 -0.10 -0.66 117.46 122.71 2cnp n PHE 70 Ca 0.07 0.83 0.01 0.00 -0.76 0.00 0.00 57.45 57.60 2cnp n PHE 70 Cb 0.59 -0.54 0.33 0.00 0.35 0.00 0.00 39.48 40.22 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 0.49 -0.53 -4.13 5.75 -1.95 0.85 115.11 115.60 2cnp h GLN 71 Ca 0.11 -0.09 -0.09 0.00 -0.15 0.00 0.00 58.65 58.43 2cnp h GLN 71 Cb 0.27 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 2cnp h GLN 71 CO -0.62 0.50 -0.01 0.93 -2.65 0.00 0.00 178.83 176.97 2cnp h GLU 72 N 0.48 0.93 -0.33 1.69 5.08 -1.55 0.34 114.58 121.23 2cnp h GLU 72 Ca 0.11 -0.30 0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2cnp h GLU 72 Cb 0.26 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.38 2cnp h GLU 72 CO 0.00 0.95 -0.02 -0.92 -1.00 0.00 0.00 179.01 178.03 2cnp h TYR 73 N 0.80 -0.05 -0.38 4.33 3.20 0.23 0.29 116.97 125.40 2cnp h TYR 73 Ca 0.15 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.08 2cnp h TYR 73 Cb 0.54 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 2cnp h TYR 73 CO 0.04 -0.08 0.26 0.82 -1.64 0.00 0.00 178.16 177.56 2cnp h ILE 74 N 0.07 1.00 -0.02 1.81 1.08 -0.38 -0.21 117.51 120.86 2cnp h ILE 74 Ca 0.16 -0.12 -0.13 0.00 -0.39 0.00 0.00 64.86 64.37 2cnp h ILE 74 Cb 0.22 0.61 -0.02 0.00 -3.07 0.00 0.00 36.82 34.57 2cnp h ILE 74 CO -0.28 0.07 -0.61 0.74 -0.69 0.00 0.00 178.15 177.37 2cnp h THR 75 N 0.36 1.42 0.60 -0.27 2.02 0.14 0.36 112.91 117.55 2cnp h THR 75 Ca 0.16 -2.05 -0.03 0.00 0.77 0.00 0.00 66.41 65.26 2cnp h THR 75 Cb 0.19 2.09 0.01 0.00 -1.74 0.00 0.00 68.15 68.69 2cnp h THR 75 CO -0.04 0.59 -0.29 0.15 0.37 0.00 0.00 175.52 176.31 2cnp h PHE 76 N 0.06 -0.75 -0.74 3.16 3.57 0.12 0.40 116.94 122.76 2cnp h PHE 76 Ca -0.01 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 2cnp h PHE 76 Cb 1.09 0.25 -0.03 0.00 2.79 0.00 0.00 35.95 40.04 2cnp h PHE 76 CO 0.01 -0.44 0.41 -0.07 -2.23 0.00 0.00 178.31 175.99 2cnp h LEU 77 N -0.90 0.91 -0.26 0.59 3.38 -1.15 -0.36 115.31 117.53 2cnp h LEU 77 Ca -0.08 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 2cnp h LEU 77 Cb 0.65 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2cnp h LEU 77 CO 0.14 0.74 0.06 1.23 0.09 0.00 0.00 178.44 180.69 2cnp h GLY 78 N 1.01 0.45 0.98 0.83 0.00 -0.26 0.10 103.07 106.18 2cnp h GLY 78 Ca 0.26 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 2cnp h GLY 78 CO -0.04 0.27 0.23 0.00 0.00 0.00 0.00 176.54 177.00 2cnp h ALA 79 N 0.88 0.49 -0.07 3.60 0.00 -0.77 0.11 119.26 123.50 2cnp h ALA 79 Ca 0.08 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2cnp h ALA 79 Cb 0.30 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 2cnp h ALA 79 CO 0.00 -0.01 -0.35 1.25 0.00 0.00 0.00 179.25 180.15 2cnp h LEU 80 N 0.51 -1.07 -0.04 0.00 5.85 -0.80 0.12 115.31 119.88 2cnp h LEU 80 Ca 0.14 0.14 0.04 0.00 0.84 0.00 0.00 57.88 59.04 2cnp h LEU 80 Cb 0.01 0.44 -0.06 0.00 0.37 0.00 0.00 40.66 41.42 2cnp h LEU 80 CO -0.03 -0.39 -0.37 0.00 -0.34 0.00 0.00 178.44 177.32 2cnp h ALA 81 N 0.26 -0.53 -0.34 1.25 0.00 -0.56 -0.35 119.26 118.98 2cnp h ALA 81 Ca 0.08 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.04 2cnp h ALA 81 Cb 0.58 0.66 -0.08 0.00 0.00 0.00 0.00 17.79 18.95 2cnp h ALA 81 CO -0.33 -0.88 -0.23 1.98 0.00 0.00 0.00 179.25 179.80 2cnp h MET 82 N -0.50 -0.18 0.43 0.00 1.85 -0.43 0.88 114.93 116.98 2cnp h MET 82 Ca 0.06 0.01 -0.02 0.00 -0.61 0.00 0.00 59.70 59.15 2cnp h MET 82 Cb 0.60 0.04 0.00 0.00 0.43 0.00 0.00 31.60 32.67 2cnp h MET 82 CO -0.31 -0.12 -0.21 0.82 -0.40 0.00 0.00 176.91 176.69 2cnp h ILE 83 N -0.19 0.00 -0.38 1.77 2.04 -0.64 -3.34 117.51 116.77 2cnp h ILE 83 Ca 0.17 -0.14 -0.11 0.00 1.00 0.00 0.00 64.86 65.79 2cnp h ILE 83 Cb 0.45 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 2cnp h ILE 83 CO -0.45 0.00 -0.21 0.10 0.00 0.00 0.00 178.15 177.59 2cnp h TYR 84 N -0.72 0.83 -0.21 1.37 -0.00 -0.99 -2.82 116.97 114.43 2cnp h TYR 84 Ca -0.06 -0.18 -0.71 0.00 0.00 0.00 0.00 58.73 57.78 2cnp h TYR 84 Cb 0.45 -0.20 -0.05 0.00 0.00 0.00 0.00 36.73 36.92 2cnp h TYR 84 CO 0.08 0.88 3.05 0.09 -0.00 0.00 0.00 178.16 182.25 2cnp n ASN 85 N -4.12 4.62 -0.31 0.10 3.02 0.30 -4.79 115.26 114.08 2cnp n ASN 85 Ca 0.00 -2.86 0.13 0.00 -0.03 0.00 0.00 54.58 51.83 2cnp n ASN 85 Cb 0.42 -1.62 0.26 0.00 -0.61 0.00 0.00 39.78 38.23 2cnp n ASN 85 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2cnp n GLU 86 N 5.45 -0.07 -0.21 3.52 -0.58 -1.06 -0.22 120.64 127.46 2cnp n GLU 86 Ca 0.53 1.32 0.00 0.00 -0.42 0.00 0.00 57.16 58.59 2cnp n GLU 86 Cb 0.37 -2.10 0.03 0.00 -0.57 0.00 0.00 31.44 29.17 2cnp n GLU 86 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2cnp n ALA 87 N -3.23 -0.04 -0.34 0.62 0.00 -1.26 -0.68 120.51 115.59 2cnp n ALA 87 Ca 0.21 0.55 0.19 0.00 0.00 0.00 0.00 53.44 54.39 2cnp n ALA 87 Cb 0.67 -0.26 0.41 0.00 0.00 0.00 0.00 19.45 20.27 2cnp n ALA 87 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2cnp h LEU 88 N 0.00 0.57 -1.20 0.00 3.38 -0.86 -0.57 115.31 116.62 2cnp h LEU 88 Ca 0.20 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2cnp h LEU 88 Cb 0.34 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2cnp h LEU 88 CO -0.55 -0.00 0.00 0.11 0.09 0.00 0.00 178.44 178.09 2cnp h LYS 89 N 0.46 0.00 -0.01 1.13 1.57 -1.08 -3.51 116.57 115.12 2cnp h LYS 89 Ca 0.67 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.45 2cnp h LYS 89 Cb 1.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.68 2cnp h LYS 89 CO -0.53 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 178.76