#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cez h PRO 11 N 0.00 0.81 -6.55 -0.72 0.13 -1.79 -3.44 132.00 120.44 3cez h PRO 11 Ca 0.00 -0.31 -0.54 0.00 -0.87 0.00 0.00 66.00 64.28 3cez h PRO 11 Cb 0.00 -0.05 0.05 0.00 0.13 0.00 0.00 31.00 31.13 3cez h PRO 11 CO 0.00 0.93 1.00 0.98 -0.23 0.00 0.00 178.00 180.68 3cez n TYR 12 N -4.31 2.58 -2.18 1.56 9.36 -0.43 -4.87 117.16 118.86 3cez n TYR 12 Ca -0.01 0.03 -0.42 0.00 3.32 0.00 0.00 57.90 60.82 3cez n TYR 12 Cb 0.36 -2.66 -0.03 0.00 -0.63 0.00 0.00 39.34 36.38 3cez n TYR 12 CO 0.00 0.00 0.00 -2.14 0.22 0.00 0.00 176.86 174.94 3cez s PRO 13 N 1.79 4.31 -0.15 2.98 0.02 -1.26 -4.81 135.00 137.88 3cez s PRO 13 Ca 0.79 2.05 -0.29 0.00 0.02 0.00 0.00 61.00 63.57 3cez s PRO 13 Cb -0.55 -3.32 -0.02 0.00 0.02 0.00 0.00 34.50 30.64 3cez s PRO 13 CO 0.36 -0.46 1.31 -1.59 -0.33 0.00 0.00 177.00 176.29 3cez s LYS 14 N 1.36 4.23 -0.39 5.54 0.00 -1.26 -4.98 119.74 124.24 3cez s LYS 14 Ca 0.65 1.72 0.01 0.00 0.00 0.00 0.00 55.97 58.35 3cez s LYS 14 Cb -0.36 -3.79 0.13 0.00 0.00 0.00 0.00 37.83 33.82 3cez s LYS 14 CO 0.30 -0.72 0.22 0.34 0.00 0.00 0.00 175.35 175.48 3cez s ASP 15 N 2.12 3.36 0.13 0.03 -1.08 -1.26 -5.03 116.67 114.93 3cez s ASP 15 Ca 0.57 -2.34 -0.13 0.00 -0.52 0.00 0.00 52.55 50.12 3cez s ASP 15 Cb -0.23 -0.72 -0.03 0.00 -1.46 0.00 0.00 42.92 40.48 3cez s ASP 15 CO 0.16 -0.30 1.52 -0.78 0.52 0.00 0.00 175.17 176.30 3cez h ASP 16 N 6.97 0.82 -0.62 -0.34 3.58 -1.99 -0.33 116.42 124.52 3cez h ASP 16 Ca 0.01 -0.38 0.01 0.00 0.42 0.00 0.00 57.03 57.09 3cez h ASP 16 Cb 0.95 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.74 3cez h ASP 16 CO 0.38 1.02 0.40 0.00 -2.88 0.00 0.00 179.24 178.17 3cez h ALA 17 N 0.83 0.79 -0.01 -0.78 0.00 -1.99 0.11 119.26 118.21 3cez h ALA 17 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3cez h ALA 17 Cb 0.69 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3cez h ALA 17 CO 0.05 0.19 0.01 1.49 0.00 0.00 0.00 179.25 180.99 3cez h GLU 18 N 0.81 0.02 -0.66 0.00 4.22 -1.92 -2.22 114.58 114.83 3cez h GLU 18 Ca 0.23 -0.00 0.09 0.00 0.08 0.00 0.00 59.36 59.76 3cez h GLU 18 Cb -0.06 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.12 3cez h GLU 18 CO -0.07 0.03 0.31 -0.07 -2.18 0.00 0.00 179.01 177.03 3cez h LEU 19 N -0.00 0.38 -1.44 1.64 3.38 -0.32 0.09 115.31 119.03 3cez h LEU 19 Ca 0.00 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 3cez h LEU 19 Cb 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3cez h LEU 19 CO -0.00 0.22 -0.24 0.03 0.09 0.00 0.00 178.44 178.54 3cez h ARG 20 N 0.53 0.00 -0.02 1.13 3.08 -0.73 0.21 114.38 118.58 3cez h ARG 20 Ca 0.33 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.23 3cez h ARG 20 Cb 0.35 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.41 3cez h ARG 20 CO -0.27 0.24 -0.54 0.00 -1.07 0.00 0.00 179.97 178.33 3cez h ARG 21 N 0.00 0.41 0.12 0.04 3.08 -0.66 -3.40 114.38 113.97 3cez h ARG 21 Ca -0.00 -0.41 -0.23 0.00 0.07 0.00 0.00 59.98 59.41 3cez h ARG 21 Cb 0.58 0.11 0.01 0.00 0.08 0.00 0.00 29.97 30.75 3cez h ARG 21 CO 0.03 1.07 -1.11 -0.09 -1.07 0.00 0.00 179.97 178.80 3cez h ARG 22 N -0.10 0.25 -7.00 0.04 2.43 -0.85 -3.47 114.38 105.67 3cez h ARG 22 Ca -0.06 -0.42 -0.46 0.00 -0.81 0.00 0.00 59.98 58.22 3cez h ARG 22 Cb 1.24 0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.95 3cez h ARG 22 CO 0.11 1.20 0.37 -0.51 -1.51 0.00 0.00 179.97 179.63 3cez s LEU 23 N -7.72 4.05 0.78 3.80 1.43 0.72 -5.04 118.68 116.70 3cez s LEU 23 Ca -0.18 1.84 -0.11 0.00 -1.03 0.00 0.00 54.13 54.66 3cez s LEU 23 Cb 0.03 -4.35 0.06 0.00 0.03 0.00 0.00 46.19 41.96 3cez s LEU 23 CO 0.78 -0.40 1.10 0.42 0.23 0.00 0.00 176.35 178.48 3cez s THR 24 N -1.91 3.20 0.30 5.49 -4.23 -1.26 -4.76 115.64 112.47 3cez s THR 24 Ca 0.59 0.40 0.04 0.00 -1.18 0.00 0.00 61.69 61.54 3cez s THR 24 Cb -0.15 -2.85 0.36 0.00 1.34 0.00 0.00 72.50 71.20 3cez s THR 24 CO 0.20 -0.50 1.61 -0.65 -0.54 0.00 0.00 174.62 174.74 3cez h PRO 25 N -1.11 0.09 -0.16 3.99 0.11 -1.96 0.19 132.00 133.15 3cez h PRO 25 Ca -0.44 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 3cez h PRO 25 Cb 1.24 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3cez h PRO 25 CO 0.51 0.06 -0.23 1.98 -0.21 0.00 0.00 178.00 180.11 3cez h MET 26 N 0.10 0.43 -0.96 1.05 1.85 -1.97 -0.60 114.93 114.82 3cez h MET 26 Ca 0.60 -0.25 0.04 0.00 -0.61 0.00 0.00 59.70 59.48 3cez h MET 26 Cb 1.27 0.02 -0.06 0.00 0.43 0.00 0.00 31.60 33.27 3cez h MET 26 CO -0.78 0.84 0.62 1.96 -0.40 0.00 0.00 176.91 179.15 3cez h GLN 27 N 0.05 1.15 0.07 0.39 4.20 -1.63 -0.89 115.11 118.46 3cez h GLN 27 Ca 0.02 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 3cez h GLN 27 Cb 0.80 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.32 3cez h GLN 27 CO 0.05 0.76 -0.03 -0.92 -0.67 0.00 0.00 178.83 178.02 3cez h TYR 28 N 1.18 -0.09 -0.90 2.96 3.20 -0.55 -2.46 116.97 120.32 3cez h TYR 28 Ca 0.39 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.25 3cez h TYR 28 Cb 0.04 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.30 3cez h TYR 28 CO -0.01 0.36 0.52 0.93 -1.64 0.00 0.00 178.16 178.33 3cez h GLU 29 N -0.58 1.24 0.08 1.82 4.39 -0.99 -0.06 114.58 120.48 3cez h GLU 29 Ca -0.01 -0.13 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 3cez h GLU 29 Cb 0.49 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 3cez h GLU 29 CO 0.02 0.88 -0.04 0.28 -1.16 0.00 0.00 179.01 178.99 3cez h VAL 30 N 1.25 1.11 0.09 3.13 2.07 -1.22 -0.39 116.25 122.30 3cez h VAL 30 Ca 0.32 -0.74 -0.26 0.00 0.82 0.00 0.00 66.70 66.84 3cez h VAL 30 Cb -0.02 1.59 -0.00 0.00 -1.52 0.00 0.00 31.29 31.34 3cez h VAL 30 CO -0.06 0.18 -1.16 0.71 0.02 0.00 0.00 177.57 177.26 3cez h THR 31 N -0.45 1.53 0.00 2.57 1.35 -1.37 -2.56 112.91 113.98 3cez h THR 31 Ca -0.01 -3.06 -0.37 0.00 -0.55 0.00 0.00 66.41 62.42 3cez h THR 31 Cb 0.38 2.87 -0.07 0.00 -1.73 0.00 0.00 68.15 69.60 3cez h THR 31 CO 0.02 0.89 -2.39 0.00 -0.25 0.00 0.00 175.52 173.79 3cez n GLN 32 N -3.53 0.69 -0.24 4.72 1.13 -0.04 -1.59 117.38 118.52 3cez n GLN 32 Ca -0.07 -0.00 0.07 0.00 -1.94 0.00 0.00 57.00 55.06 3cez n GLN 32 Cb 0.98 -1.52 0.17 0.00 0.11 0.00 0.00 30.24 29.99 3cez n GLN 32 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 3cez n HIS 33 N -2.77 0.52 -2.85 1.08 8.25 -0.22 -5.00 115.22 114.24 3cez n HIS 33 Ca -0.34 -0.71 -0.17 0.00 -0.26 0.00 0.00 57.72 56.24 3cez n HIS 33 Cb 1.15 -0.16 -0.00 0.00 1.12 0.00 0.00 29.99 32.10 3cez n HIS 33 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3cez n ALA 34 N -0.28 -0.91 -1.09 -1.41 0.00 -0.94 -4.89 120.51 110.99 3cez n ALA 34 Ca 0.14 0.10 -0.30 0.00 0.00 0.00 0.00 53.44 53.38 3cez n ALA 34 Cb 0.61 -2.15 0.13 0.00 0.00 0.00 0.00 19.45 18.04 3cez n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cez s ALA 35 N -2.76 1.74 -0.14 0.00 0.00 -0.81 -4.96 121.76 114.83 3cez s ALA 35 Ca 0.18 0.22 0.01 0.00 0.00 0.00 0.00 51.96 52.37 3cez s ALA 35 Cb -0.09 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 19.76 3cez s ALA 35 CO 0.22 -2.26 -0.17 0.99 0.00 0.00 0.00 175.76 174.54 3cez s THR 36 N -2.84 1.75 0.33 0.00 2.01 -1.26 -4.42 115.64 111.21 3cez s THR 36 Ca 0.63 -0.76 -0.29 0.00 0.31 0.00 0.00 61.69 61.58 3cez s THR 36 Cb -0.19 -1.60 -0.11 0.00 0.01 0.00 0.00 72.50 70.61 3cez s THR 36 CO 0.57 0.49 1.52 -1.61 -0.69 0.00 0.00 174.62 174.90 3cez s GLU 37 N 1.21 4.14 0.52 4.92 2.02 -1.26 -4.96 118.70 125.29 3cez s GLU 37 Ca 0.00 2.54 -0.22 0.00 0.02 0.00 0.00 54.97 57.31 3cez s GLU 37 Cb -0.14 -3.00 -0.06 0.00 0.10 0.00 0.00 34.13 31.03 3cez s GLU 37 CO -0.08 -0.55 1.33 -2.30 0.02 0.00 0.00 175.26 173.69 3cez n PRO 38 N 1.28 1.74 -1.71 0.39 -0.02 -1.26 -4.93 135.00 130.49 3cez n PRO 38 Ca 0.04 0.63 -0.40 0.00 -2.02 0.00 0.00 63.50 61.76 3cez n PRO 38 Cb 0.39 -2.53 0.02 0.00 -0.02 0.00 0.00 33.50 31.36 3cez n PRO 38 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3cez n PRO 39 N -0.78 1.80 -1.52 0.52 -0.04 -1.26 -2.78 135.00 130.94 3cez n PRO 39 Ca 0.10 0.65 -0.15 0.00 -0.04 0.00 0.00 63.50 64.05 3cez n PRO 39 Cb 0.44 -2.42 -0.06 0.00 -0.04 0.00 0.00 33.50 31.41 3cez n PRO 39 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3cez n PHE 40 N -0.54 -0.06 0.06 0.54 3.72 0.12 -4.87 117.46 116.43 3cez n PHE 40 Ca 0.08 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.50 3cez n PHE 40 Cb 0.42 -2.74 -0.03 0.00 -0.94 0.00 0.00 39.48 36.18 3cez n PHE 40 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3cez n THR 41 N -2.68 0.00 -2.87 4.37 -2.24 -1.12 -5.06 114.28 104.69 3cez n THR 41 Ca -0.16 -0.19 -0.33 0.00 -2.27 0.00 0.00 64.05 61.10 3cez n THR 41 Cb 0.52 0.59 -0.07 0.00 -2.10 0.00 0.00 70.33 69.27 3cez n THR 41 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3cez s GLY 42 N -2.15 2.38 0.32 3.38 0.00 -1.26 -4.98 107.32 105.02 3cez s GLY 42 Ca -0.01 0.35 0.06 0.00 0.00 0.00 0.00 44.72 45.12 3cez s GLY 42 CO 0.18 0.62 1.84 -2.09 0.00 0.00 0.00 173.10 173.65 3cez h GLU 43 N 1.96 0.79 -0.34 2.90 4.81 -1.97 -3.22 114.58 119.52 3cez h GLU 43 Ca -0.49 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 3cez h GLU 43 Cb 1.18 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.38 3cez h GLU 43 CO 0.62 0.52 0.00 0.66 -0.73 0.00 0.00 179.01 180.08 3cez n TYR 44 N -4.61 0.44 -0.20 0.92 4.01 -1.26 -4.64 117.16 111.81 3cez n TYR 44 Ca 0.19 -0.26 0.01 0.00 -0.16 0.00 0.00 57.90 57.68 3cez n TYR 44 Cb 0.45 -0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.59 3cez n TYR 44 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 3cez h THR 45 N 3.87 0.63 -0.34 -0.72 2.02 -1.88 -2.53 112.91 113.96 3cez h THR 45 Ca 0.00 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.09 3cez h THR 45 Cb 0.89 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 3cez h THR 45 CO 0.00 0.05 0.00 0.47 0.37 0.00 0.00 175.52 176.41 3cez n ASP 46 N -5.13 3.16 -4.73 4.18 8.00 -1.26 -4.39 116.55 116.37 3cez n ASP 46 Ca 0.09 -2.21 -0.42 0.00 0.71 0.00 0.00 54.79 52.96 3cez n ASP 46 Cb 0.33 -0.30 -0.03 0.00 -0.02 0.00 0.00 41.12 41.10 3cez n ASP 46 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3cez s THR 47 N -1.37 2.44 0.00 -3.53 2.01 -0.95 -4.91 115.64 109.32 3cez s THR 47 Ca 0.28 0.33 0.00 0.00 0.31 0.00 0.00 61.69 62.60 3cez s THR 47 Cb 0.17 -3.21 0.00 0.00 0.01 0.00 0.00 72.50 69.47 3cez s THR 47 CO 0.15 0.03 0.62 -0.62 -0.69 0.00 0.00 174.62 174.11 3cez n GLU 48 N 3.54 0.53 -2.22 4.92 1.02 -1.26 -5.03 120.64 122.14 3cez n GLU 48 Ca 0.13 -0.79 -0.36 0.00 -0.02 0.00 0.00 57.16 56.11 3cez n GLU 48 Cb 0.38 -0.92 -0.00 0.00 -0.02 0.00 0.00 31.44 30.88 3cez n GLU 48 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3cez s ASP 49 N -0.34 5.91 0.26 1.62 1.01 -1.26 -4.98 116.67 118.89 3cez s ASP 49 Ca 0.00 2.28 -0.29 0.00 0.71 0.00 0.00 52.55 55.25 3cez s ASP 49 Cb 0.00 -2.60 -0.09 0.00 1.01 0.00 0.00 42.92 41.24 3cez s ASP 49 CO 0.00 -1.10 1.17 0.00 0.21 0.00 0.00 175.17 175.45 3cez s ALA 50 N -1.62 3.44 0.00 5.23 0.00 -1.26 -4.78 121.76 122.77 3cez s ALA 50 Ca 0.68 0.98 0.00 0.00 0.00 0.00 0.00 51.96 53.63 3cez s ALA 50 Cb -0.27 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.46 3cez s ALA 50 CO 0.32 -0.32 0.00 0.41 0.00 0.00 0.00 175.76 176.18 3cez n GLY 51 N 1.43 -1.16 3.15 0.00 0.00 -1.26 -1.03 105.19 106.32 3cez n GLY 51 Ca 0.01 -1.38 -0.27 0.00 0.00 0.00 0.00 46.02 44.38 3cez n GLY 51 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cez s ILE 52 N -2.60 1.49 -0.28 -0.61 -1.09 -0.17 -1.00 121.20 116.93 3cez s ILE 52 Ca 0.00 -0.75 -0.12 0.00 -2.23 0.00 0.00 60.65 57.55 3cez s ILE 52 Cb 0.00 -1.28 -0.04 0.00 -1.58 0.00 0.00 42.46 39.56 3cez s ILE 52 CO 0.00 0.43 0.24 -0.31 -1.23 0.00 0.00 174.94 174.06 3cez s TYR 53 N 0.02 3.23 0.04 3.97 2.02 0.12 -0.88 117.35 125.87 3cez s TYR 53 Ca -0.04 0.15 0.02 0.00 -0.37 0.00 0.00 57.07 56.83 3cez s TYR 53 Cb -0.12 -2.43 -0.04 0.00 -0.40 0.00 0.00 41.96 38.97 3cez s TYR 53 CO 0.02 -0.20 0.05 -1.01 -1.57 0.00 0.00 175.55 172.85 3cez s HIS 54 N 1.83 3.17 0.06 2.71 3.76 -0.62 -0.36 115.29 125.84 3cez s HIS 54 Ca 0.09 0.10 -0.35 0.00 -0.15 0.00 0.00 55.06 54.75 3cez s HIS 54 Cb -0.16 -1.66 -0.14 0.00 1.11 0.00 0.00 32.58 31.73 3cez s HIS 54 CO 0.11 0.51 1.57 0.00 -0.85 0.00 0.00 174.74 176.08 3cez h VAL 56 N 3.97 0.29 0.00 0.00 3.04 -1.21 -1.41 116.25 120.93 3cez h VAL 56 Ca -0.46 -0.45 0.00 0.00 -1.01 0.00 0.00 66.70 64.78 3cez h VAL 56 Cb 1.28 1.34 0.00 0.00 -2.01 0.00 0.00 31.29 31.91 3cez h VAL 56 CO 0.87 0.07 -0.28 0.58 -1.01 0.00 0.00 177.57 177.80 3cez h VAL 57 N 0.00 0.00 -0.00 1.51 2.07 -1.89 -3.42 116.25 114.51 3cez h VAL 57 Ca -0.00 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.65 3cez h VAL 57 Cb 0.34 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 3cez h VAL 57 CO 0.01 0.00 -0.80 0.00 0.02 0.00 0.00 177.57 176.80 3cez n GLY 59 N 1.42 0.89 3.77 0.00 0.00 -0.53 -5.00 105.19 105.73 3cez n GLY 59 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 3cez n GLY 59 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3cez s THR 60 N -3.51 2.57 -0.05 2.61 2.01 -1.26 -4.55 115.64 113.46 3cez s THR 60 Ca 0.00 0.57 -0.30 0.00 0.31 0.00 0.00 61.69 62.27 3cez s THR 60 Cb 0.00 -3.36 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 3cez s THR 60 CO 0.00 0.13 1.35 0.00 -0.69 0.00 0.00 174.62 175.41 3cez s ALA 61 N -1.06 3.58 -0.13 7.40 0.00 -1.26 -0.80 121.76 129.49 3cez s ALA 61 Ca 0.50 0.74 -0.03 0.00 0.00 0.00 0.00 51.96 53.17 3cez s ALA 61 Cb -0.41 -3.60 -0.07 0.00 0.00 0.00 0.00 23.12 19.04 3cez s ALA 61 CO 0.54 -0.98 -0.14 1.28 0.00 0.00 0.00 175.76 176.46 3cez n LEU 62 N 5.78 2.04 -3.85 0.00 4.77 0.52 -4.85 117.00 121.42 3cez n LEU 62 Ca 0.13 0.04 -0.12 0.00 -0.03 0.00 0.00 56.01 56.03 3cez n LEU 62 Cb 0.44 -0.42 -0.13 0.00 -2.33 0.00 0.00 43.42 40.98 3cez n LEU 62 CO 0.58 0.51 -0.28 -0.36 -1.33 0.00 0.00 177.39 176.51 3cez s PHE 63 N -2.25 -0.08 0.15 -1.77 0.08 -0.93 -0.90 117.98 112.28 3cez s PHE 63 Ca -0.18 0.20 -0.06 0.00 0.12 0.00 0.00 56.93 57.01 3cez s PHE 63 Cb 0.06 0.03 -0.06 0.00 -0.57 0.00 0.00 43.02 42.48 3cez s PHE 63 CO 0.27 -0.04 0.41 -1.21 -0.10 0.00 0.00 175.22 174.54 3cez s GLU 64 N 0.02 3.67 0.51 0.44 2.02 -1.26 0.13 118.70 124.23 3cez s GLU 64 Ca -0.00 0.01 0.26 0.00 0.02 0.00 0.00 54.97 55.26 3cez s GLU 64 Cb -0.01 -2.83 1.36 0.00 0.10 0.00 0.00 34.13 32.75 3cez s GLU 64 CO 0.00 0.45 1.93 0.66 0.02 0.00 0.00 175.26 178.33 3cez h SER 65 N 2.89 0.08 0.98 -0.19 4.64 -1.37 -1.58 113.55 119.00 3cez h SER 65 Ca -0.47 0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 60.84 3cez h SER 65 Cb 1.17 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3cez h SER 65 CO 0.71 0.04 -0.08 1.23 -0.87 0.00 0.00 176.83 177.86 3cez h GLY 66 N 0.09 0.00 -0.16 -0.77 0.00 -1.93 -2.03 103.07 98.27 3cez h GLY 66 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 3cez h GLY 66 CO -0.03 0.00 -0.15 0.00 0.00 0.00 0.00 176.54 176.36 3cez n ALA 67 N -2.15 2.86 -1.93 3.60 0.00 -0.60 -4.93 120.51 117.37 3cez n ALA 67 Ca 0.00 -0.44 -0.39 0.00 0.00 0.00 0.00 53.44 52.61 3cez n ALA 67 Cb 0.35 -1.13 -0.06 0.00 0.00 0.00 0.00 19.45 18.61 3cez n ALA 67 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3cez s LYS 68 N -2.28 4.63 0.17 0.00 2.20 -0.77 -1.42 119.74 122.28 3cez s LYS 68 Ca 0.30 1.23 -0.09 0.00 -0.36 0.00 0.00 55.97 57.05 3cez s LYS 68 Cb 0.20 -3.26 -0.01 0.00 -1.51 0.00 0.00 37.83 33.25 3cez s LYS 68 CO 0.44 0.56 0.28 1.52 -0.36 0.00 0.00 175.35 177.79 3cez s TYR 69 N -1.16 0.45 -0.58 4.03 1.13 -0.33 -4.97 117.35 115.92 3cez s TYR 69 Ca 0.37 -0.81 -0.26 0.00 -1.41 0.00 0.00 57.07 54.96 3cez s TYR 69 Cb -0.24 -0.08 0.04 0.00 -1.10 0.00 0.00 41.96 40.58 3cez s TYR 69 CO 0.27 -0.73 1.06 -1.01 -2.51 0.00 0.00 175.55 172.64 3cez s HIS 70 N -3.99 2.67 -0.05 -3.49 3.76 -1.26 -4.45 115.29 108.49 3cez s HIS 70 Ca 0.19 0.10 0.21 0.00 -0.15 0.00 0.00 55.06 55.42 3cez s HIS 70 Cb 0.03 -4.30 -0.33 0.00 1.11 0.00 0.00 32.58 29.10 3cez s HIS 70 CO 0.01 -1.52 0.43 -1.13 -0.85 0.00 0.00 174.74 171.69 3cez n SER 71 N 8.00 0.09 -0.05 1.40 3.41 -1.26 -4.99 113.62 120.22 3cez n SER 71 Ca 0.04 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.64 3cez n SER 71 Cb 0.48 1.89 -0.00 0.00 -0.26 0.00 0.00 64.21 66.31 3cez n SER 71 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3cez n GLY 72 N 1.33 0.18 0.20 5.00 0.00 -1.26 -4.89 105.19 105.75 3cez n GLY 72 Ca -0.07 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.06 3cez n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cez n GLY 74 N 1.12 0.79 3.16 0.00 0.00 -1.26 -4.80 105.19 104.19 3cez n GLY 74 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 3cez n GLY 74 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3cez s TRP 75 N -2.00 0.94 0.08 1.61 0.51 -1.26 -0.70 118.94 118.12 3cez s TRP 75 Ca 0.00 -0.73 -0.36 0.00 -2.12 0.00 0.00 56.10 52.89 3cez s TRP 75 Cb 0.00 -0.53 -0.18 0.00 -0.81 0.00 0.00 33.47 31.96 3cez s TRP 75 CO 0.00 -0.07 1.13 -2.30 -0.51 0.00 0.00 176.95 175.20 3cez n PRO 76 N 0.47 0.63 -3.84 4.98 -0.02 -1.21 -4.81 135.00 131.20 3cez n PRO 76 Ca -0.16 0.23 -0.14 0.00 -2.02 0.00 0.00 63.50 61.41 3cez n PRO 76 Cb 0.58 -1.73 -0.15 0.00 -0.02 0.00 0.00 33.50 32.19 3cez n PRO 76 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3cez s SER 77 N 0.07 0.07 0.06 2.55 1.04 -1.26 -1.16 113.70 115.07 3cez s SER 77 Ca 0.83 0.01 0.04 0.00 0.48 0.00 0.00 55.95 57.31 3cez s SER 77 Cb -1.05 -0.04 -0.03 0.00 0.10 0.00 0.00 66.02 65.01 3cez s SER 77 CO 0.53 -0.06 -0.12 -0.31 0.98 0.00 0.00 173.24 174.26 3cez s TYR 78 N 0.49 1.02 -1.61 5.02 2.02 -0.93 -1.19 117.35 122.18 3cez s TYR 78 Ca -0.04 -0.45 0.23 0.00 -0.37 0.00 0.00 57.07 56.43 3cez s TYR 78 Cb -0.06 -0.59 0.09 0.00 -0.40 0.00 0.00 41.96 41.00 3cez s TYR 78 CO -0.01 0.01 1.14 1.97 -1.57 0.00 0.00 175.55 177.08 3cez n PHE 79 N 1.44 0.00 -3.50 2.71 -1.74 -0.51 -0.19 117.46 115.67 3cez n PHE 79 Ca -0.21 0.00 -0.17 0.00 -0.56 0.00 0.00 57.45 56.51 3cez n PHE 79 Cb 0.54 -0.04 -0.05 0.00 1.52 0.00 0.00 39.48 41.45 3cez n PHE 79 CO 0.00 0.00 0.00 -1.59 -0.56 0.00 0.00 176.76 174.61 3cez s LYS 80 N -2.68 1.10 0.85 3.97 -2.85 -1.26 -4.49 119.74 114.38 3cez s LYS 80 Ca 0.16 0.12 -0.10 0.00 -1.00 0.00 0.00 55.97 55.15 3cez s LYS 80 Cb 0.18 0.51 0.15 0.00 -2.06 0.00 0.00 37.83 36.61 3cez s LYS 80 CO 0.66 -0.37 1.18 -1.25 0.10 0.00 0.00 175.35 175.67 3cez s PRO 81 N -1.67 1.24 0.14 1.78 0.04 -1.26 -4.74 135.00 130.53 3cez s PRO 81 Ca -0.09 -0.56 -0.12 0.00 0.04 0.00 0.00 61.00 60.27 3cez s PRO 81 Cb -0.00 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.51 3cez s PRO 81 CO 0.06 -1.92 1.57 0.97 0.04 0.00 0.00 177.00 177.72 3cez h ILE 82 N -1.14 1.27 -4.30 0.56 2.10 -1.35 -3.45 117.51 111.20 3cez h ILE 82 Ca -0.42 -1.15 -0.29 0.00 1.08 0.00 0.00 64.86 64.08 3cez h ILE 82 Cb 1.26 1.06 -0.10 0.00 -1.09 0.00 0.00 36.82 37.95 3cez h ILE 82 CO 0.44 0.40 -0.30 1.51 -1.08 0.00 0.00 178.15 179.11 3cez s ASP 83 N -6.42 0.88 0.00 2.19 1.47 -1.26 -5.05 116.67 108.48 3cez s ASP 83 Ca -0.12 -1.47 0.19 0.00 1.18 0.00 0.00 52.55 52.32 3cez s ASP 83 Cb 0.11 0.60 1.11 0.00 -0.34 0.00 0.00 42.92 44.40 3cez s ASP 83 CO 0.83 -1.17 1.67 0.61 0.68 0.00 0.00 175.17 177.79 3cez n GLY 84 N -0.52 -0.94 0.02 2.12 0.00 -1.26 -3.59 105.19 101.02 3cez n GLY 84 Ca 0.02 -0.12 0.03 0.00 0.00 0.00 0.00 46.02 45.95 3cez n GLY 84 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cez n GLU 85 N -0.81 0.91 0.21 1.61 -0.58 -1.26 -4.64 120.64 116.07 3cez n GLU 85 Ca 0.14 -0.09 0.14 0.00 -0.42 0.00 0.00 57.16 56.93 3cez n GLU 85 Cb 0.06 -1.33 0.47 0.00 -0.57 0.00 0.00 31.44 30.08 3cez n GLU 85 CO 0.00 0.00 0.00 -0.39 -0.48 0.00 0.00 177.13 176.26 3cez h VAL 86 N 0.00 0.00 -3.35 2.62 -1.51 -1.93 -3.43 116.25 108.64 3cez h VAL 86 Ca -0.11 -0.58 -0.65 0.00 -1.23 0.00 0.00 66.70 64.13 3cez h VAL 86 Cb 1.01 1.52 -0.26 0.00 -2.13 0.00 0.00 31.29 31.44 3cez h VAL 86 CO 0.01 0.00 -0.75 -0.63 -1.23 0.00 0.00 177.57 174.97 3cez s ILE 87 N -3.39 3.22 -0.18 7.19 1.01 -1.26 -1.33 121.20 126.46 3cez s ILE 87 Ca 0.05 -0.60 -0.14 0.00 0.00 0.00 0.00 60.65 59.95 3cez s ILE 87 Cb 0.08 -2.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 3cez s ILE 87 CO 0.55 0.52 0.30 -0.62 0.00 0.00 0.00 174.94 175.70 3cez s ASP 88 N 0.29 6.39 -0.07 3.58 2.15 0.02 -4.79 116.67 124.23 3cez s ASP 88 Ca -0.08 0.46 -0.03 0.00 0.43 0.00 0.00 52.55 53.32 3cez s ASP 88 Cb -0.15 -2.18 -0.04 0.00 -0.30 0.00 0.00 42.92 40.25 3cez s ASP 88 CO 0.05 0.05 0.06 -1.61 -0.17 0.00 0.00 175.17 173.55 3cez s GLU 89 N 0.75 3.14 -0.13 4.34 2.02 -1.26 -0.29 118.70 127.28 3cez s GLU 89 Ca 0.16 -0.35 -0.09 0.00 0.02 0.00 0.00 54.97 54.71 3cez s GLU 89 Cb -0.13 -2.93 0.04 0.00 0.10 0.00 0.00 34.13 31.21 3cez s GLU 89 CO 0.05 0.71 0.32 0.21 0.02 0.00 0.00 175.26 176.57 3cez s LYS 90 N -1.15 0.33 0.37 1.61 2.20 -0.53 -5.00 119.74 117.57 3cez s LYS 90 Ca 0.16 0.54 -0.28 0.00 -0.36 0.00 0.00 55.97 56.03 3cez s LYS 90 Cb -0.12 0.05 -0.11 0.00 -1.51 0.00 0.00 37.83 36.15 3cez s LYS 90 CO 0.06 -0.10 1.44 -1.64 -0.36 0.00 0.00 175.35 174.75 3cez s MET 91 N 0.74 4.12 -0.17 4.03 -1.94 -1.26 -0.02 119.30 124.80 3cez s MET 91 Ca -0.05 2.48 -0.01 0.00 -1.71 0.00 0.00 55.69 56.41 3cez s MET 91 Cb -0.06 -2.96 0.04 0.00 2.01 0.00 0.00 34.83 33.87 3cez s MET 91 CO -0.05 -0.49 -0.05 0.34 -0.01 0.00 0.00 175.02 174.77 3cez s ASP 92 N -0.25 2.91 -0.07 3.03 2.15 0.14 -4.77 116.67 119.81 3cez s ASP 92 Ca 0.53 -0.71 0.16 0.00 0.43 0.00 0.00 52.55 52.96 3cez s ASP 92 Cb -0.45 -0.92 0.55 0.00 -0.30 0.00 0.00 42.92 41.80 3cez s ASP 92 CO 0.60 -0.19 1.46 -1.22 -0.17 0.00 0.00 175.17 175.66 3cez n TYR 93 N 4.87 0.99 -1.84 -5.34 4.01 -1.26 -0.49 117.16 118.10 3cez n TYR 93 Ca -0.12 -0.59 -0.31 0.00 -0.16 0.00 0.00 57.90 56.72 3cez n TYR 93 Cb 0.47 -0.14 0.01 0.00 -0.31 0.00 0.00 39.34 39.38 3cez n TYR 93 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3cez s THR 94 N -1.56 4.59 -1.43 -0.72 -4.23 -1.24 -4.13 115.64 106.92 3cez s THR 94 Ca 0.41 0.86 -0.03 0.00 -1.18 0.00 0.00 61.69 61.74 3cez s THR 94 Cb 0.25 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 70.31 3cez s THR 94 CO 0.21 -1.08 0.41 1.41 -0.54 0.00 0.00 174.62 175.03 3cez n HIS 95 N -2.76 -1.53 -1.68 3.99 8.25 -1.26 -2.57 115.22 117.66 3cez n HIS 95 Ca 0.06 0.35 -0.14 0.00 -0.26 0.00 0.00 57.72 57.74 3cez n HIS 95 Cb 0.54 -3.99 -0.04 0.00 1.12 0.00 0.00 29.99 27.62 3cez n HIS 95 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3cez n GLY 96 N -1.34 0.90 3.17 -1.41 0.00 -1.26 -4.99 105.19 100.26 3cez n GLY 96 Ca -0.13 -0.35 -0.11 0.00 0.00 0.00 0.00 46.02 45.43 3cez n GLY 96 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3cez s MET 97 N -3.67 0.83 -0.25 1.61 -1.94 -1.06 -5.12 119.30 109.70 3cez s MET 97 Ca 0.00 -1.31 -0.04 0.00 -1.71 0.00 0.00 55.69 52.63 3cez s MET 97 Cb 0.00 -0.22 0.01 0.00 2.01 0.00 0.00 34.83 36.62 3cez s MET 97 CO 0.00 -0.01 -0.02 0.99 -0.01 0.00 0.00 175.02 175.97 3cez s THR 98 N -3.51 3.33 0.22 2.05 2.01 -1.26 -3.72 115.64 114.76 3cez s THR 98 Ca 0.11 -0.72 -0.01 0.00 0.31 0.00 0.00 61.69 61.39 3cez s THR 98 Cb 0.04 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.90 3cez s THR 98 CO -0.04 0.27 0.16 -0.13 -0.69 0.00 0.00 174.62 174.19 3cez s ARG 99 N 1.43 1.27 -0.41 4.92 0.52 0.36 -4.98 118.95 122.06 3cez s ARG 99 Ca 0.03 -1.66 -0.10 0.00 -0.52 0.00 0.00 55.73 53.49 3cez s ARG 99 Cb -0.16 0.28 0.07 0.00 0.52 0.00 0.00 34.95 35.67 3cez s ARG 99 CO -0.02 -0.43 0.26 0.08 0.02 0.00 0.00 175.30 175.21 3cez s VAL 100 N -4.08 4.33 0.46 3.52 1.01 -1.26 0.29 120.40 124.67 3cez s VAL 100 Ca 0.39 -1.29 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 3cez s VAL 100 Cb 0.06 -3.61 -0.08 0.00 0.00 0.00 0.00 36.38 32.75 3cez s VAL 100 CO 0.14 -0.47 1.10 -0.70 0.00 0.00 0.00 175.10 175.17 3cez s GLU 101 N 1.46 3.83 -0.07 2.72 2.12 0.97 -1.06 118.70 128.67 3cez s GLU 101 Ca 0.03 1.58 0.04 0.00 0.36 0.00 0.00 54.97 56.98 3cez s GLU 101 Cb -0.22 -2.32 -0.02 0.00 0.26 0.00 0.00 34.13 31.83 3cez s GLU 101 CO 0.03 -0.45 -0.18 0.08 -0.54 0.00 0.00 175.26 174.21 3cez s VAL 102 N -1.71 2.73 0.15 3.70 1.01 0.03 -1.45 120.40 124.86 3cez s VAL 102 Ca 0.64 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.85 3cez s VAL 102 Cb -0.23 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 3cez s VAL 102 CO 0.28 0.57 -0.13 -0.13 0.00 0.00 0.00 175.10 175.69 3cez s ARG 103 N -0.33 1.10 -0.03 2.72 0.52 0.61 -1.52 118.95 122.01 3cez s ARG 103 Ca 0.02 -1.38 -0.30 0.00 -0.52 0.00 0.00 55.73 53.55 3cez s ARG 103 Cb -0.13 -0.84 -0.06 0.00 0.52 0.00 0.00 34.95 34.45 3cez s ARG 103 CO 0.02 0.14 1.55 0.00 0.02 0.00 0.00 175.30 177.03 3cez h ASN 105 N 8.76 0.00 0.08 0.00 -1.24 -1.48 0.36 115.58 122.05 3cez h ASN 105 Ca -0.38 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 56.52 3cez h ASN 105 Cb 1.17 0.00 0.01 0.00 0.73 0.00 0.00 38.32 40.23 3cez h ASN 105 CO 0.94 0.00 -0.50 -0.61 -1.29 0.00 0.00 177.43 175.97 3cez h GLN 106 N 0.00 0.16 0.00 6.67 5.75 -1.90 -3.42 115.11 122.37 3cez h GLN 106 Ca 0.00 -0.28 0.00 0.00 -0.15 0.00 0.00 58.65 58.22 3cez h GLN 106 Cb 0.49 0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.14 3cez h GLN 106 CO 0.00 1.13 -0.58 0.00 -2.65 0.00 0.00 178.83 176.74 3cez n GLY 108 N 1.62 0.75 3.64 0.00 0.00 0.13 -4.89 105.19 106.44 3cez n GLY 108 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 3cez n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cez n ALA 109 N -0.53 0.42 -1.98 4.61 0.00 -1.25 -4.53 120.51 117.24 3cez n ALA 109 Ca 0.00 0.41 -0.42 0.00 0.00 0.00 0.00 53.44 53.43 3cez n ALA 109 Cb 0.00 -2.16 -0.03 0.00 0.00 0.00 0.00 19.45 17.26 3cez n ALA 109 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3cez s HIS 110 N -0.44 2.53 -0.17 0.00 2.46 -0.62 -0.52 115.29 118.54 3cez s HIS 110 Ca 0.66 0.42 -0.05 0.00 0.47 0.00 0.00 55.06 56.56 3cez s HIS 110 Cb -0.70 -3.91 -0.08 0.00 -0.13 0.00 0.00 32.58 27.76 3cez s HIS 110 CO 0.54 -3.59 -0.19 1.28 -2.47 0.00 0.00 174.74 170.31 3cez n LEU 111 N 5.47 1.82 0.00 8.88 4.77 -0.57 -4.06 117.00 133.31 3cez n LEU 111 Ca 0.15 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 3cez n LEU 111 Cb 0.41 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3cez n LEU 111 CO 0.62 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.79 3cez n GLY 112 N 2.21 -0.74 3.04 -0.72 0.00 -1.07 -1.49 105.19 106.43 3cez n GLY 112 Ca -0.32 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 3cez n GLY 112 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3cez s HIS 113 N -3.40 0.44 -0.03 1.61 3.76 -0.77 -0.79 115.29 116.11 3cez s HIS 113 Ca 0.00 -0.76 0.07 0.00 -0.15 0.00 0.00 55.06 54.22 3cez s HIS 113 Cb 0.00 -0.31 -0.02 0.00 1.11 0.00 0.00 32.58 33.36 3cez s HIS 113 CO 0.00 -0.25 -0.24 0.54 -0.85 0.00 0.00 174.74 173.94 3cez s VAL 114 N -2.52 2.20 0.14 -0.90 0.11 -0.22 0.34 120.40 119.55 3cez s VAL 114 Ca -0.05 -1.05 0.05 0.00 -2.93 0.00 0.00 61.98 58.00 3cez s VAL 114 Cb -0.02 -1.78 -0.04 0.00 -1.53 0.00 0.00 36.38 33.00 3cez s VAL 114 CO -0.04 0.58 -0.11 -0.36 -3.33 0.00 0.00 175.10 171.84 3cez s PHE 115 N -0.56 1.25 -0.25 1.54 0.08 -0.42 -4.24 117.98 115.38 3cez s PHE 115 Ca 0.08 -0.71 0.14 0.00 0.12 0.00 0.00 56.93 56.56 3cez s PHE 115 Cb -0.11 -0.64 0.82 0.00 -0.57 0.00 0.00 43.02 42.52 3cez s PHE 115 CO -0.00 0.08 1.75 0.39 -0.10 0.00 0.00 175.22 177.34 3cez n GLU 116 N 0.04 4.83 -1.05 0.44 1.02 -1.26 -0.83 120.64 123.82 3cez n GLU 116 Ca -0.12 -3.14 -0.15 0.00 -0.02 0.00 0.00 57.16 53.73 3cez n GLU 116 Cb 0.60 -2.27 0.20 0.00 -0.02 0.00 0.00 31.44 29.95 3cez n GLU 116 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3cez n ASP 117 N 0.57 3.47 -2.03 1.62 5.75 -1.24 -4.76 116.55 119.93 3cez n ASP 117 Ca 0.29 -3.60 0.00 0.00 -0.01 0.00 0.00 54.79 51.46 3cez n ASP 117 Cb 1.21 -0.75 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 3cez n ASP 117 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3cez n GLY 118 N -1.01 -0.75 3.54 6.12 0.00 -0.40 -4.79 105.19 107.91 3cez n GLY 118 Ca 0.48 -1.72 -0.47 0.00 0.00 0.00 0.00 46.02 44.31 3cez n GLY 118 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3cez n PRO 119 N -0.96 1.63 0.26 1.61 -0.02 -1.26 -4.45 135.00 131.80 3cez n PRO 119 Ca 0.00 0.46 0.11 0.00 -2.02 0.00 0.00 63.50 62.05 3cez n PRO 119 Cb 0.00 -2.87 0.71 0.00 -0.02 0.00 0.00 33.50 31.32 3cez n PRO 119 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3cez h ARG 120 N 13.43 0.00 -0.01 -0.52 3.08 -1.91 0.13 114.38 128.59 3cez h ARG 120 Ca -0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.69 3cez h ARG 120 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3cez h ARG 120 CO 0.98 0.09 0.00 -0.40 -1.07 0.00 0.00 179.97 179.58 3cez n ASP 121 N -3.97 0.27 0.00 7.04 5.75 -1.26 -4.68 116.55 119.70 3cez n ASP 121 Ca -0.02 -1.17 0.00 0.00 -0.01 0.00 0.00 54.79 53.58 3cez n ASP 121 Cb 0.18 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 3cez n ASP 121 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3cez n LYS 122 N -0.75 0.00 0.13 0.11 5.02 -0.68 -5.01 118.16 116.99 3cez n LYS 122 Ca 0.21 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.62 3cez n LYS 122 Cb 0.14 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.30 3cez n LYS 122 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 3cez h THR 123 N 0.00 0.00 0.00 -0.18 1.35 -1.82 -3.48 112.91 108.79 3cez h THR 123 Ca 0.00 -0.80 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 3cez h THR 123 Cb 0.00 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 3cez h THR 123 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3cez n GLY 124 N 1.21 0.27 3.72 5.82 0.00 0.37 -4.97 105.19 111.61 3cez n GLY 124 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 3cez n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cez s LEU 125 N 0.00 3.84 -0.43 0.99 1.43 -1.26 -1.28 118.68 121.97 3cez s LEU 125 Ca 0.00 0.21 -0.02 0.00 -1.03 0.00 0.00 54.13 53.29 3cez s LEU 125 Cb 0.00 -1.91 0.12 0.00 0.03 0.00 0.00 46.19 44.42 3cez s LEU 125 CO 0.00 0.34 0.22 -0.60 0.23 0.00 0.00 176.35 176.54 3cez s ARG 126 N -0.63 2.03 -0.55 1.70 3.52 -0.01 -4.11 118.95 120.89 3cez s ARG 126 Ca 0.11 -1.92 -0.28 0.00 -0.13 0.00 0.00 55.73 53.51 3cez s ARG 126 Cb -0.12 -3.57 0.02 0.00 -1.56 0.00 0.00 34.95 29.73 3cez s ARG 126 CO 0.02 -1.08 1.26 0.71 -0.81 0.00 0.00 175.30 175.41 3cez s TYR 127 N 0.96 2.53 -0.46 5.12 2.02 0.74 -1.30 117.35 126.95 3cez s TYR 127 Ca 0.10 0.49 -0.16 0.00 -0.37 0.00 0.00 57.07 57.13 3cez s TYR 127 Cb -0.22 -4.46 0.06 0.00 -0.40 0.00 0.00 41.96 36.94 3cez s TYR 127 CO -0.04 -1.69 0.40 0.00 -1.57 0.00 0.00 175.55 172.65 3cez s ILE 129 N 1.78 2.35 0.16 0.00 -1.09 -0.31 -1.85 121.20 122.25 3cez s ILE 129 Ca 0.06 -0.95 -0.31 0.00 -2.23 0.00 0.00 60.65 57.22 3cez s ILE 129 Cb -0.22 -1.89 -0.11 0.00 -1.58 0.00 0.00 42.46 38.65 3cez s ILE 129 CO 0.08 0.56 1.77 0.20 -1.23 0.00 0.00 174.94 176.33 3cez s ASN 130 N -0.08 6.41 0.38 3.58 -0.87 -0.56 -3.28 114.94 120.53 3cez s ASN 130 Ca -0.05 2.80 0.14 0.00 -1.57 0.00 0.00 52.86 54.18 3cez s ASN 130 Cb -0.14 -2.58 0.98 0.00 -0.02 0.00 0.00 41.25 39.48 3cez s ASN 130 CO 0.04 -0.98 1.83 0.28 -2.57 0.00 0.00 177.10 175.70 3cez h SER 131 N 7.74 0.52 0.41 -1.22 0.02 -1.93 -1.51 113.55 117.59 3cez h SER 131 Ca -0.44 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.56 3cez h SER 131 Cb 1.21 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.71 3cez h SER 131 CO 0.95 0.20 0.00 0.00 -1.14 0.00 0.00 176.83 176.84 3cez n ALA 132 N -2.46 1.95 1.18 3.77 0.00 -1.26 -1.32 120.51 122.37 3cez n ALA 132 Ca 0.21 -0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.69 3cez n ALA 132 Cb 0.66 -1.30 0.33 0.00 0.00 0.00 0.00 19.45 19.14 3cez n ALA 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cez n ALA 133 N -1.34 3.22 -2.35 0.00 0.00 -0.57 -4.38 120.51 115.09 3cez n ALA 133 Ca 0.08 -0.41 -0.19 0.00 0.00 0.00 0.00 53.44 52.92 3cez n ALA 133 Cb 0.16 -1.11 -0.10 0.00 0.00 0.00 0.00 19.45 18.41 3cez n ALA 133 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3cez s LEU 134 N -2.59 2.53 -0.03 0.00 1.43 -0.43 -0.77 118.68 118.81 3cez s LEU 134 Ca 0.21 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 52.26 3cez s LEU 134 Cb 0.19 -0.63 0.03 0.00 0.03 0.00 0.00 46.19 45.81 3cez s LEU 134 CO 0.56 -0.22 -0.00 0.21 0.23 0.00 0.00 176.35 177.13 3cez s ASN 135 N -3.33 0.58 -0.14 2.29 2.47 -0.22 -4.63 114.94 111.96 3cez s ASN 135 Ca 0.23 -0.03 -0.21 0.00 0.42 0.00 0.00 52.86 53.27 3cez s ASN 135 Cb 0.00 -0.25 -0.03 0.00 -1.45 0.00 0.00 41.25 39.52 3cez s ASN 135 CO 0.07 -0.11 0.61 0.12 -3.72 0.00 0.00 177.10 174.07 3cez s PHE 136 N 1.12 3.47 -0.43 0.43 5.36 -1.26 -1.59 117.98 125.08 3cez s PHE 136 Ca -0.08 1.01 -0.14 0.00 -0.96 0.00 0.00 56.93 56.75 3cez s PHE 136 Cb -0.13 -2.74 0.04 0.00 -0.34 0.00 0.00 43.02 39.85 3cez s PHE 136 CO -0.02 -0.01 0.32 -2.00 -1.46 0.00 0.00 175.22 172.05 3cez s GLU 137 N 1.26 2.94 0.18 10.12 2.12 -0.06 -4.98 118.70 130.28 3cez s GLU 137 Ca 0.30 -1.15 -0.31 0.00 0.36 0.00 0.00 54.97 54.17 3cez s GLU 137 Cb -0.16 -3.99 -0.09 0.00 0.26 0.00 0.00 34.13 30.14 3cez s GLU 137 CO 0.12 -0.84 1.44 0.00 -0.54 0.00 0.00 175.26 175.44 3cez s ALA 138 N 1.64 3.64 0.00 6.30 0.00 -1.26 -1.00 121.76 131.08 3cez s ALA 138 Ca 0.04 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.24 3cez s ALA 138 Cb -0.21 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.35 3cez s ALA 138 CO 0.08 -0.68 0.00 1.63 0.00 0.00 0.00 175.76 176.79