#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cdn s SER 2 N 0.00 4.85 0.30 4.39 1.04 -1.26 -4.79 113.70 118.23 1cdn s SER 2 Ca 0.00 1.89 0.06 0.00 0.48 0.00 0.00 55.95 58.38 1cdn s SER 2 Cb 0.00 -2.53 0.80 0.00 0.10 0.00 0.00 66.02 64.39 1cdn s SER 2 CO 0.00 -1.80 1.67 -0.65 0.98 0.00 0.00 173.24 173.44 1cdn h PRO 3 N -0.54 0.31 -0.22 4.02 0.11 -2.02 0.15 132.00 133.80 1cdn h PRO 3 Ca -0.45 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.65 1cdn h PRO 3 Cb 1.24 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1cdn h PRO 3 CO 0.53 0.20 0.12 0.93 -0.21 0.00 0.00 178.00 179.57 1cdn h GLU 4 N 0.32 0.24 -0.35 1.05 5.08 -1.99 0.12 114.58 119.04 1cdn h GLU 4 Ca 0.60 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.94 1cdn h GLU 4 Cb 1.22 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 1cdn h GLU 4 CO -0.59 0.16 0.20 0.93 -1.00 0.00 0.00 179.01 178.70 1cdn h GLU 5 N 0.24 0.48 -0.97 2.33 5.08 -1.48 -0.90 114.58 119.36 1cdn h GLU 5 Ca 0.09 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1cdn h GLU 5 Cb 0.01 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.11 1cdn h GLU 5 CO -0.05 0.39 0.64 -0.07 -1.00 0.00 0.00 179.01 178.92 1cdn h LEU 6 N 0.44 1.08 0.40 1.33 3.38 -0.33 0.25 115.31 121.86 1cdn h LEU 6 Ca 0.12 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1cdn h LEU 6 Cb 0.05 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.54 1cdn h LEU 6 CO -0.02 0.76 -0.19 0.50 0.09 0.00 0.00 178.44 179.58 1cdn h LYS 7 N 1.27 -0.51 -0.47 1.13 1.63 -0.56 0.22 116.57 119.28 1cdn h LYS 7 Ca 0.37 0.04 0.09 0.00 -0.85 0.00 0.00 60.65 60.30 1cdn h LYS 7 Cb -0.07 0.12 -0.08 0.00 -0.60 0.00 0.00 32.23 31.60 1cdn h LYS 7 CO -0.10 -0.34 -0.03 0.78 -3.45 0.00 0.00 179.45 176.31 1cdn h GLY 8 N -0.54 0.44 0.95 5.01 0.00 -0.29 -0.00 103.07 108.63 1cdn h GLY 8 Ca -0.05 0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 1cdn h GLY 8 CO 0.09 -0.14 -0.11 -2.22 0.00 0.00 0.00 176.54 174.16 1cdn h ILE 9 N 0.08 0.77 -0.46 2.60 1.08 -0.51 0.11 117.51 121.18 1cdn h ILE 9 Ca 0.23 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.79 1cdn h ILE 9 Cb 0.35 0.77 -0.10 0.00 -3.07 0.00 0.00 36.82 34.77 1cdn h ILE 9 CO -0.41 0.00 -0.28 0.15 -0.69 0.00 0.00 178.15 176.92 1cdn h PHE 10 N -0.28 -0.74 0.30 1.37 3.04 0.23 -0.73 116.94 120.13 1cdn h PHE 10 Ca -0.02 0.06 -0.01 0.00 3.98 0.00 0.00 57.97 61.98 1cdn h PHE 10 Cb 0.23 0.40 0.00 0.00 2.56 0.00 0.00 35.95 39.14 1cdn h PHE 10 CO -0.09 -0.35 -0.14 0.93 -2.02 0.00 0.00 178.31 176.65 1cdn h GLU 11 N -0.18 -0.38 -0.77 1.11 5.08 -0.75 0.65 114.58 119.33 1cdn h GLU 11 Ca 0.21 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.71 1cdn h GLU 11 Cb 0.51 0.09 -0.13 0.00 0.50 0.00 0.00 28.75 29.71 1cdn h GLU 11 CO -0.56 -0.24 -0.39 -0.22 -1.00 0.00 0.00 179.01 176.60 1cdn h LYS 12 N -0.42 -0.10 0.10 2.33 3.64 -0.00 0.48 116.57 122.60 1cdn h LYS 12 Ca -0.04 0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.16 1cdn h LYS 12 Cb 0.32 0.02 0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1cdn h LYS 12 CO 0.07 -0.06 -0.78 1.88 -2.27 0.00 0.00 179.45 178.28 1cdn h TYR 13 N -0.10 0.60 -0.96 1.91 0.05 -1.07 -3.30 116.97 114.10 1cdn h TYR 13 Ca 0.27 -0.40 0.18 0.00 0.05 0.00 0.00 58.73 58.83 1cdn h TYR 13 Cb 0.57 -0.04 -0.09 0.00 1.01 0.00 0.00 36.73 38.18 1cdn h TYR 13 CO -0.76 1.27 0.61 0.00 -1.05 0.00 0.00 178.16 178.22 1cdn h ALA 14 N 0.17 1.86 0.00 3.88 0.00 -0.43 0.55 119.26 125.29 1cdn h ALA 14 Ca -0.12 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1cdn h ALA 14 Cb 1.56 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1cdn h ALA 14 CO 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.23 1cdn n ALA 15 N -2.41 1.81 -1.29 0.00 0.00 0.12 -3.53 120.51 115.21 1cdn n ALA 15 Ca 0.21 0.05 -0.37 0.00 0.00 0.00 0.00 53.44 53.32 1cdn n ALA 15 Cb 0.58 -1.39 -0.02 0.00 0.00 0.00 0.00 19.45 18.61 1cdn n ALA 15 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1cdn n LYS 16 N -2.15 3.13 -2.17 0.00 5.02 0.18 -4.56 118.16 117.61 1cdn n LYS 16 Ca 0.03 -2.14 0.00 0.00 -2.02 0.00 0.00 58.31 54.18 1cdn n LYS 16 Cb 0.27 -2.85 0.00 0.00 -0.02 0.00 0.00 35.03 32.43 1cdn n LYS 16 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1cdn n GLU 17 N 4.41 -5.45 0.00 1.97 1.02 -1.26 -4.85 120.64 116.49 1cdn n GLU 17 Ca 0.66 3.89 0.00 0.00 -0.02 0.00 0.00 57.16 61.69 1cdn n GLU 17 Cb 0.26 -4.43 0.00 0.00 -0.02 0.00 0.00 31.44 27.25 1cdn n GLU 17 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1cdn n GLY 18 N 1.88 0.43 3.67 0.62 0.00 -1.23 -4.83 105.19 105.72 1cdn n GLY 18 Ca 0.00 -1.76 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 1cdn n GLY 18 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1cdn s ASP 19 N 0.00 7.08 0.59 1.61 2.15 -1.24 -4.75 116.67 122.10 1cdn s ASP 19 Ca 0.00 1.57 0.29 0.00 0.43 0.00 0.00 52.55 54.83 1cdn s ASP 19 Cb 0.00 -2.55 1.53 0.00 -0.30 0.00 0.00 42.92 41.60 1cdn s ASP 19 CO 0.00 -0.64 1.96 1.55 -0.17 0.00 0.00 175.17 177.87 1cdn h PRO 20 N 7.59 0.00 -0.00 4.34 0.13 -1.92 0.49 132.00 142.63 1cdn h PRO 20 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1cdn h PRO 20 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1cdn h PRO 20 CO 0.94 0.00 -0.24 0.09 -0.23 0.00 0.00 178.00 178.56 1cdn n ASN 21 N -3.76 0.46 -3.47 1.44 3.02 -1.26 -4.52 115.26 107.16 1cdn n ASN 21 Ca 0.06 -0.29 -0.04 0.00 -0.03 0.00 0.00 54.58 54.28 1cdn n ASN 21 Cb 0.56 -0.03 -0.06 0.00 -0.61 0.00 0.00 39.78 39.64 1cdn n ASN 21 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1cdn s GLN 22 N -2.76 0.44 -0.04 3.52 0.74 0.16 -3.76 119.66 117.97 1cdn s GLN 22 Ca 0.19 1.02 -0.29 0.00 0.05 0.00 0.00 55.36 56.33 1cdn s GLN 22 Cb 0.19 0.33 -0.02 0.00 1.10 0.00 0.00 33.01 34.60 1cdn s GLN 22 CO 0.57 -0.41 0.97 -0.51 -0.55 0.00 0.00 175.29 175.36 1cdn s LEU 23 N 2.72 4.32 0.79 3.68 1.43 0.23 -3.68 118.68 128.17 1cdn s LEU 23 Ca 0.06 1.58 -0.07 0.00 -1.03 0.00 0.00 54.13 54.66 1cdn s LEU 23 Cb -0.13 -3.53 0.13 0.00 0.03 0.00 0.00 46.19 42.68 1cdn s LEU 23 CO -0.17 -0.32 1.10 -0.94 0.23 0.00 0.00 176.35 176.26 1cdn s SER 24 N 1.03 4.12 0.20 2.29 1.04 -1.26 -0.81 113.70 120.31 1cdn s SER 24 Ca 0.50 0.10 -0.10 0.00 0.48 0.00 0.00 55.95 56.92 1cdn s SER 24 Cb -0.20 -0.47 0.23 0.00 0.10 0.00 0.00 66.02 65.68 1cdn s SER 24 CO 0.24 -2.04 1.79 0.11 0.98 0.00 0.00 173.24 174.31 1cdn h LYS 25 N -0.89 0.56 -0.21 4.02 1.57 -1.97 -1.52 116.57 118.12 1cdn h LYS 25 Ca -0.42 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.30 1cdn h LYS 25 Cb 1.27 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 1cdn h LYS 25 CO 0.46 0.37 0.03 0.93 -0.57 0.00 0.00 179.45 180.66 1cdn h GLU 26 N 0.57 0.35 -0.24 3.15 5.08 -1.96 0.30 114.58 121.83 1cdn h GLU 26 Ca 0.28 -0.10 0.06 0.00 -1.00 0.00 0.00 59.36 58.60 1cdn h GLU 26 Cb 0.23 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.38 1cdn h GLU 26 CO -0.21 0.51 -0.14 0.93 -1.00 0.00 0.00 179.01 179.11 1cdn h GLU 27 N 0.14 -0.12 -0.84 2.33 3.07 -1.80 0.23 114.58 117.60 1cdn h GLU 27 Ca 0.06 0.01 0.09 0.00 -0.50 0.00 0.00 59.36 59.02 1cdn h GLU 27 Cb 0.34 0.03 -0.07 0.00 -0.84 0.00 0.00 28.75 28.20 1cdn h GLU 27 CO 0.01 -0.08 0.49 -0.07 -1.40 0.00 0.00 179.01 177.96 1cdn h LEU 28 N -0.12 0.71 0.66 1.33 3.38 -0.84 0.51 115.31 120.95 1cdn h LEU 28 Ca 0.13 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1cdn h LEU 28 Cb 0.32 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 40.98 1cdn h LEU 28 CO -0.32 0.41 -0.32 0.50 0.09 0.00 0.00 178.44 178.81 1cdn h LYS 29 N 0.83 -0.85 -0.67 1.13 3.64 0.87 0.23 116.57 121.75 1cdn h LYS 29 Ca 0.40 0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.87 1cdn h LYS 29 Cb 0.34 0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.31 1cdn h LYS 29 CO -0.24 -0.56 0.41 -0.07 -2.27 0.00 0.00 179.45 176.73 1cdn h LEU 30 N -0.92 0.67 0.08 5.20 -0.00 -0.81 0.14 115.31 119.67 1cdn h LEU 30 Ca -0.09 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.82 1cdn h LEU 30 Cb 0.69 -0.14 -0.05 0.00 -0.00 0.00 0.00 40.66 41.16 1cdn h LEU 30 CO 0.15 0.46 -0.44 0.25 -0.00 0.00 0.00 178.44 178.86 1cdn h LEU 31 N 0.80 -1.31 0.34 1.67 6.46 -0.74 0.07 115.31 122.60 1cdn h LEU 31 Ca 0.27 0.15 -0.00 0.00 -0.12 0.00 0.00 57.88 58.18 1cdn h LEU 31 Cb 0.04 0.50 -0.03 0.00 -0.73 0.00 0.00 40.66 40.44 1cdn h LEU 31 CO -0.12 -0.49 -0.45 -0.07 -0.62 0.00 0.00 178.44 176.70 1cdn h LEU 32 N -0.65 -1.25 -0.07 2.25 3.38 0.15 0.34 115.31 119.46 1cdn h LEU 32 Ca 0.03 0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.15 1cdn h LEU 32 Cb 0.69 0.43 -0.06 0.00 0.09 0.00 0.00 40.66 41.81 1cdn h LEU 32 CO -0.28 -0.57 -0.31 1.56 0.09 0.00 0.00 178.44 178.93 1cdn h GLN 33 N -0.83 -0.41 -0.06 1.13 1.08 -0.65 0.94 115.11 116.30 1cdn h GLN 33 Ca -0.03 0.03 -0.16 0.00 -1.45 0.00 0.00 58.65 57.04 1cdn h GLN 33 Cb 0.77 0.09 0.01 0.00 -0.05 0.00 0.00 27.48 28.30 1cdn h GLN 33 CO -0.12 -0.27 -0.58 1.15 -0.95 0.00 0.00 178.83 178.05 1cdn h THR 34 N -0.42 1.38 0.00 -0.54 2.02 -0.88 -3.37 112.91 111.09 1cdn h THR 34 Ca 0.08 -1.95 -0.34 0.00 0.77 0.00 0.00 66.41 64.97 1cdn h THR 34 Cb 0.54 2.34 -0.07 0.00 -1.74 0.00 0.00 68.15 69.23 1cdn h THR 34 CO -0.31 0.58 -2.36 -0.62 0.37 0.00 0.00 175.52 173.18 1cdn n GLU 35 N -4.19 0.70 -3.18 6.66 -0.58 0.10 -4.77 120.64 115.38 1cdn n GLU 35 Ca -0.09 -0.02 -0.21 0.00 -0.42 0.00 0.00 57.16 56.42 1cdn n GLU 35 Cb 0.65 -1.52 -0.04 0.00 -0.57 0.00 0.00 31.44 29.96 1cdn n GLU 35 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1cdn n PHE 36 N -2.72 0.50 0.25 -0.32 3.72 0.32 -4.86 117.46 114.35 1cdn n PHE 36 Ca -0.31 -3.78 0.10 0.00 -0.05 0.00 0.00 57.45 53.41 1cdn n PHE 36 Cb 1.12 -0.41 0.68 0.00 -0.94 0.00 0.00 39.48 39.92 1cdn n PHE 36 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1cdn h PRO 37 N 3.31 0.00 0.00 -1.08 0.13 -1.71 -0.45 132.00 132.19 1cdn h PRO 37 Ca 0.10 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 1cdn h PRO 37 Cb 0.89 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.02 1cdn h PRO 37 CO 0.53 0.00 -0.04 0.77 -0.23 0.00 0.00 178.00 179.03 1cdn h SER 38 N 0.00 0.00 0.00 1.44 0.02 -1.90 -1.16 113.55 111.95 1cdn h SER 38 Ca 0.02 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.80 1cdn h SER 38 Cb 0.08 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.59 1cdn h SER 38 CO -0.00 0.04 -1.09 0.18 -1.14 0.00 0.00 176.83 174.82 1cdn n LEU 39 N -3.50 1.85 -0.27 5.07 4.77 -0.33 -4.63 117.00 119.96 1cdn n LEU 39 Ca -0.02 0.48 0.01 0.00 -0.03 0.00 0.00 56.01 56.45 1cdn n LEU 39 Cb 0.15 -0.93 0.08 0.00 -2.33 0.00 0.00 43.42 40.39 1cdn n LEU 39 CO 0.26 0.06 0.69 0.25 -1.33 0.00 0.00 177.39 177.31 1cdn h LEU 40 N -1.00 -0.83 0.00 2.23 5.85 -0.48 -3.41 115.31 117.67 1cdn h LEU 40 Ca -0.26 0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1cdn h LEU 40 Cb 1.07 0.52 0.00 0.00 0.37 0.00 0.00 40.66 42.62 1cdn h LEU 40 CO -0.16 -0.27 0.00 0.29 -0.34 0.00 0.00 178.44 177.97 1cdn n LYS 41 N -5.50 0.00 0.00 1.25 5.02 -0.50 -0.31 118.16 118.12 1cdn n LYS 41 Ca 0.10 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.49 1cdn n LYS 41 Cb 0.39 0.00 0.61 0.00 -0.02 0.00 0.00 35.03 36.01 1cdn n LYS 41 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1cdn n GLY 42 N 0.00 -0.84 5.00 0.72 0.00 -1.26 -4.92 105.19 103.89 1cdn n GLY 42 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1cdn n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cdn n GLY 43 N 0.60 1.55 7.00 -0.02 0.00 0.57 -4.94 105.19 109.95 1cdn n GLY 43 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1cdn n GLY 43 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1cdn n SER 44 N 3.55 0.00 -4.12 1.61 2.88 -1.26 -4.52 113.62 111.76 1cdn n SER 44 Ca 0.00 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.34 1cdn n SER 44 Cb 0.00 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.32 1cdn n SER 44 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1cdn s THR 45 N 0.00 1.03 0.25 2.46 -4.23 -1.26 -5.02 115.64 108.88 1cdn s THR 45 Ca 0.00 -0.83 -0.03 0.00 -1.18 0.00 0.00 61.69 59.65 1cdn s THR 45 Cb 0.00 -0.92 0.23 0.00 1.34 0.00 0.00 72.50 73.15 1cdn s THR 45 CO 0.00 0.08 1.81 -0.07 -0.54 0.00 0.00 174.62 175.90 1cdn h LEU 46 N 5.23 0.69 -0.09 4.79 3.38 -2.00 -1.08 115.31 126.24 1cdn h LEU 46 Ca -0.36 0.05 0.04 0.00 0.09 0.00 0.00 57.88 57.71 1cdn h LEU 46 Cb 1.18 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 1cdn h LEU 46 CO 0.46 0.38 -0.24 0.44 0.09 0.00 0.00 178.44 179.56 1cdn h ASP 47 N 0.80 -0.74 0.02 -0.43 5.19 -1.97 0.35 116.42 119.63 1cdn h ASP 47 Ca 0.42 0.11 0.02 0.00 -0.62 0.00 0.00 57.03 56.97 1cdn h ASP 47 Cb 0.43 0.32 -0.03 0.00 0.18 0.00 0.00 39.33 40.24 1cdn h ASP 47 CO -0.27 -0.30 -0.13 -0.08 -3.12 0.00 0.00 179.24 175.34 1cdn h GLU 48 N -0.33 -0.23 -0.57 3.56 4.57 -1.76 0.28 114.58 120.10 1cdn h GLU 48 Ca 0.09 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.35 1cdn h GLU 48 Cb 0.46 0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 29.05 1cdn h GLU 48 CO -0.28 -0.15 0.27 -0.07 -1.18 0.00 0.00 179.01 177.60 1cdn h LEU 49 N -0.24 0.36 0.03 1.64 -0.00 -0.87 0.63 115.31 116.86 1cdn h LEU 49 Ca 0.04 0.04 0.01 0.00 -0.00 0.00 0.00 57.88 57.97 1cdn h LEU 49 Cb 0.29 -0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 40.92 1cdn h LEU 49 CO -0.12 0.23 -0.06 0.15 -0.00 0.00 0.00 178.44 178.65 1cdn h PHE 50 N 0.50 -0.14 -0.38 1.13 3.57 0.13 0.15 116.94 121.91 1cdn h PHE 50 Ca 0.26 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.78 1cdn h PHE 50 Cb 0.22 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 1cdn h PHE 50 CO -0.12 -0.09 0.23 1.49 -2.23 0.00 0.00 178.31 177.60 1cdn h GLU 51 N -0.11 0.46 -0.64 1.11 4.57 -0.56 0.13 114.58 119.54 1cdn h GLU 51 Ca 0.01 -0.03 0.05 0.00 -1.18 0.00 0.00 59.36 58.21 1cdn h GLU 51 Cb 0.13 -0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 28.56 1cdn h GLU 51 CO -0.04 0.31 0.36 1.49 -1.18 0.00 0.00 179.01 179.95 1cdn h GLU 52 N 0.48 0.67 -0.12 1.92 4.22 -0.41 -2.96 114.58 118.39 1cdn h GLU 52 Ca 0.15 -0.04 -0.10 0.00 0.08 0.00 0.00 59.36 59.45 1cdn h GLU 52 Cb -0.02 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1cdn h GLU 52 CO -0.05 0.44 -0.30 -0.07 -2.18 0.00 0.00 179.01 176.85 1cdn h LEU 53 N 0.69 0.47 -5.63 1.64 3.38 -0.33 -3.36 115.31 112.17 1cdn h LEU 53 Ca 0.27 -0.59 -0.57 0.00 0.09 0.00 0.00 57.88 57.08 1cdn h LEU 53 Cb 0.13 -0.14 0.02 0.00 0.09 0.00 0.00 40.66 40.76 1cdn h LEU 53 CO -0.15 0.97 3.00 -0.67 0.09 0.00 0.00 178.44 181.67 1cdn n ASP 54 N -4.41 5.31 -0.34 -0.43 2.03 0.41 -4.44 116.55 114.68 1cdn n ASP 54 Ca -0.07 -2.56 0.09 0.00 0.52 0.00 0.00 54.79 52.77 1cdn n ASP 54 Cb 0.48 -1.33 0.28 0.00 -0.72 0.00 0.00 41.12 39.82 1cdn n ASP 54 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1cdn h LYS 55 N 6.21 0.88 0.00 -0.67 1.79 -1.72 0.50 116.57 123.56 1cdn h LYS 55 Ca 0.60 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 59.02 1cdn h LYS 55 Cb 0.38 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 1cdn h LYS 55 CO 1.73 0.59 0.00 0.27 -1.08 0.00 0.00 179.45 180.95 1cdn n ASN 56 N -4.62 0.00 -2.88 0.86 2.04 -1.26 -4.93 115.26 104.46 1cdn n ASN 56 Ca 0.19 -0.19 -0.21 0.00 -0.44 0.00 0.00 54.58 53.93 1cdn n ASN 56 Cb 0.40 -0.26 0.04 0.00 -2.53 0.00 0.00 39.78 37.44 1cdn n ASN 56 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1cdn n GLY 57 N 1.04 -0.43 0.14 4.83 0.00 0.17 -4.90 105.19 106.04 1cdn n GLY 57 Ca 0.14 0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.37 1cdn n GLY 57 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1cdn h ASP 58 N -1.47 0.00 0.00 1.61 3.04 -1.92 -3.47 116.42 114.21 1cdn h ASP 58 Ca -0.50 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.29 1cdn h ASP 58 Cb 1.34 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.63 1cdn h ASP 58 CO 0.53 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 178.34 1cdn n GLY 59 N 1.03 0.72 3.62 7.15 0.00 -1.26 -5.06 105.19 111.39 1cdn n GLY 59 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 1cdn n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cdn s GLU 60 N -0.80 1.74 -0.35 1.61 2.02 -1.26 -4.93 118.70 116.73 1cdn s GLU 60 Ca 0.00 -1.37 -0.07 0.00 0.02 0.00 0.00 54.97 53.56 1cdn s GLU 60 Cb 0.00 0.50 0.04 0.00 0.10 0.00 0.00 34.13 34.77 1cdn s GLU 60 CO 0.00 -0.74 0.13 0.08 0.02 0.00 0.00 175.26 174.74 1cdn s VAL 61 N -3.57 3.88 0.52 2.63 1.01 0.01 -4.74 120.40 120.14 1cdn s VAL 61 Ca 0.22 -1.13 -0.17 0.00 0.00 0.00 0.00 61.98 60.90 1cdn s VAL 61 Cb -0.02 -3.21 -0.07 0.00 0.00 0.00 0.00 36.38 33.08 1cdn s VAL 61 CO 0.12 -0.21 1.00 -0.44 0.00 0.00 0.00 175.10 175.56 1cdn s SER 62 N 1.47 6.48 0.27 3.32 0.01 -1.26 -0.60 113.70 123.39 1cdn s SER 62 Ca -0.01 1.64 0.01 0.00 1.31 0.00 0.00 55.95 58.89 1cdn s SER 62 Cb -0.20 -2.52 0.60 0.00 0.21 0.00 0.00 66.02 64.11 1cdn s SER 62 CO 0.03 -0.68 1.75 0.15 0.41 0.00 0.00 173.24 174.89 1cdn h PHE 63 N 0.92 0.76 -0.74 2.43 3.57 -1.98 0.11 116.94 122.01 1cdn h PHE 63 Ca -0.47 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.09 1cdn h PHE 63 Cb 1.19 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.69 1cdn h PHE 63 CO 0.62 0.13 0.49 1.05 -2.23 0.00 0.00 178.31 178.37 1cdn h GLU 64 N 0.58 0.90 0.01 1.11 4.11 -1.93 -2.53 114.58 116.83 1cdn h GLU 64 Ca 0.49 -0.05 -0.30 0.00 0.07 0.00 0.00 59.36 59.57 1cdn h GLU 64 Cb 0.77 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.76 1cdn h GLU 64 CO -0.40 0.60 -1.79 -0.85 0.07 0.00 0.00 179.01 176.63 1cdn n GLU 65 N -4.44 0.64 -0.08 1.06 0.28 -0.40 -3.55 120.64 114.16 1cdn n GLU 65 Ca 0.09 0.27 0.26 0.00 -0.16 0.00 0.00 57.16 57.61 1cdn n GLU 65 Cb 0.09 -1.76 0.70 0.00 1.43 0.00 0.00 31.44 31.90 1cdn n GLU 65 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 1cdn h PHE 66 N 0.00 0.00 -0.80 -1.84 3.57 -0.60 0.71 116.94 117.99 1cdn h PHE 66 Ca -0.32 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.41 1cdn h PHE 66 Cb 2.04 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 40.75 1cdn h PHE 66 CO 0.00 0.00 0.70 1.96 -2.23 0.00 0.00 178.31 178.74 1cdn h GLN 67 N 0.00 0.00 -0.76 1.11 1.08 -1.51 0.25 115.11 115.29 1cdn h GLN 67 Ca 0.35 0.00 0.19 0.00 -1.45 0.00 0.00 58.65 57.73 1cdn h GLN 67 Cb 1.67 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 29.05 1cdn h GLN 67 CO -0.00 0.00 0.52 0.28 -0.95 0.00 0.00 178.83 178.68 1cdn h VAL 68 N 0.00 0.70 -0.20 -0.54 2.07 -1.11 0.16 116.25 117.32 1cdn h VAL 68 Ca 0.38 -0.07 -0.14 0.00 0.82 0.00 0.00 66.70 67.69 1cdn h VAL 68 Cb 1.77 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1cdn h VAL 68 CO -0.00 0.04 -0.42 0.25 0.02 0.00 0.00 177.57 177.45 1cdn h LEU 69 N 0.20 0.72 -0.61 2.57 6.46 -0.70 -0.37 115.31 123.58 1cdn h LEU 69 Ca 0.37 -0.55 -0.02 0.00 -0.12 0.00 0.00 57.88 57.56 1cdn h LEU 69 Cb 1.16 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.85 1cdn h LEU 69 CO -0.07 1.14 0.31 0.58 -0.62 0.00 0.00 178.44 179.77 1cdn h VAL 70 N 0.33 1.21 -0.23 1.05 2.07 -1.12 0.82 116.25 120.38 1cdn h VAL 70 Ca 0.00 -0.57 0.05 0.00 0.82 0.00 0.00 66.70 67.01 1cdn h VAL 70 Cb 1.03 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.21 1cdn h VAL 70 CO 0.09 0.24 -0.12 0.50 0.02 0.00 0.00 177.57 178.29 1cdn h LYS 71 N 0.83 -0.10 -0.68 1.57 3.64 -0.63 0.75 116.57 121.96 1cdn h LYS 71 Ca 0.21 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.71 1cdn h LYS 71 Cb 0.10 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 31.86 1cdn h LYS 71 CO -0.03 -0.07 0.27 0.87 -2.27 0.00 0.00 179.45 178.23 1cdn h LYS 72 N -0.10 0.44 -0.12 1.90 6.56 -0.27 -1.28 116.57 123.69 1cdn h LYS 72 Ca 0.13 -0.03 0.03 0.00 -1.06 0.00 0.00 60.65 59.72 1cdn h LYS 72 Cb 0.29 -0.10 -0.03 0.00 -0.57 0.00 0.00 32.23 31.82 1cdn h LYS 72 CO -0.29 0.29 -0.08 0.82 -2.06 0.00 0.00 179.45 178.13 1cdn h ILE 73 N 0.46 0.76 0.00 1.86 2.04 -0.17 -3.45 117.51 119.00 1cdn h ILE 73 Ca 0.35 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.21 1cdn h ILE 73 Cb 0.46 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1cdn h ILE 73 CO -0.33 0.00 0.00 -0.24 0.00 0.00 0.00 178.15 177.58 1cdn n SER 74 N -5.22 0.00 0.00 1.72 2.88 0.19 -5.10 113.62 108.09 1cdn n SER 74 Ca -0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 1cdn n SER 74 Cb 0.14 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.60 1cdn n SER 74 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48