#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 4.94 0.31 4.39 1.04 -1.26 -4.53 113.70 118.58 1cdn s SER 2 Ca 0.00 2.14 0.08 0.00 0.48 0.00 0.00 55.95 58.65 1cdn s SER 2 Cb 0.00 -2.57 0.87 0.00 0.10 0.00 0.00 66.02 64.42 1cdn s SER 2 CO 0.00 -1.75 1.68 -0.65 0.98 0.00 0.00 173.24 173.50 1cdn h PRO 3 N 0.13 0.35 0.05 4.02 0.11 -1.94 0.14 132.00 134.85 1cdn h PRO 3 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1cdn h PRO 3 Cb 1.26 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1cdn h PRO 3 CO 0.53 0.23 -0.05 0.93 -0.21 0.00 0.00 178.00 179.43 1cdn h GLU 4 N 0.36 -0.11 -0.38 1.05 3.07 -1.99 0.24 114.58 116.82 1cdn h GLU 4 Ca 0.63 0.01 0.03 0.00 -0.50 0.00 0.00 59.36 59.53 1cdn h GLU 4 Cb 1.30 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 29.20 1cdn h GLU 4 CO -0.58 -0.07 0.19 1.49 -1.40 0.00 0.00 179.01 178.64 1cdn h GLU 5 N -0.11 0.37 -0.80 2.33 4.57 -1.53 -0.45 114.58 118.96 1cdn h GLU 5 Ca 0.00 -0.02 0.02 0.00 -1.18 0.00 0.00 59.36 58.18 1cdn h GLU 5 Cb 0.11 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.57 1cdn h GLU 5 CO -0.01 0.25 0.53 -0.07 -1.18 0.00 0.00 179.01 178.52 1cdn h LEU 6 N 0.38 0.90 -0.18 1.64 3.38 -0.50 0.99 115.31 121.91 1cdn h LEU 6 Ca 0.16 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1cdn h LEU 6 Cb 0.08 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1cdn h LEU 6 CO -0.12 0.64 0.09 0.50 0.09 0.00 0.00 178.44 179.64 1cdn h LYS 7 N 1.05 0.25 0.09 1.13 3.11 0.20 0.26 116.57 122.66 1cdn h LYS 7 Ca 0.30 -0.03 0.02 0.00 -2.81 0.00 0.00 60.65 58.13 1cdn h LYS 7 Cb -0.07 -0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 31.07 1cdn h LYS 7 CO -0.07 0.26 -0.28 0.78 -2.81 0.00 0.00 179.45 177.33 1cdn h GLY 8 N 0.18 -0.50 0.10 5.01 0.00 0.21 0.60 103.07 108.68 1cdn h GLY 8 Ca 0.06 0.33 0.06 0.00 0.00 0.00 0.00 47.33 47.78 1cdn h GLY 8 CO -0.01 -0.23 -0.29 -2.22 0.00 0.00 0.00 176.54 173.79 1cdn h ILE 9 N -0.47 0.32 -0.41 2.60 2.04 -0.84 0.55 117.51 121.29 1cdn h ILE 9 Ca 0.04 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.98 1cdn h ILE 9 Cb 0.51 0.32 -0.08 0.00 -0.74 0.00 0.00 36.82 36.83 1cdn h ILE 9 CO -0.18 0.00 -0.09 0.15 0.00 0.00 0.00 178.15 178.04 1cdn h PHE 10 N -0.32 -0.19 0.28 1.37 3.04 0.26 0.54 116.94 121.93 1cdn h PHE 10 Ca 0.12 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 62.09 1cdn h PHE 10 Cb 0.51 0.15 0.00 0.00 2.56 0.00 0.00 35.95 39.17 1cdn h PHE 10 CO -0.42 -0.16 -0.14 0.93 -2.02 0.00 0.00 178.31 176.50 1cdn h GLU 11 N 0.02 -0.37 -0.71 1.11 5.08 -0.55 0.75 114.58 119.91 1cdn h GLU 11 Ca 0.20 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.71 1cdn h GLU 11 Cb 0.30 0.08 -0.13 0.00 0.50 0.00 0.00 28.75 29.51 1cdn h GLU 11 CO -0.41 -0.18 -0.34 -0.22 -1.00 0.00 0.00 179.01 176.86 1cdn h LYS 12 N -0.47 -0.10 0.08 2.33 3.64 -0.13 0.91 116.57 122.83 1cdn h LYS 12 Ca -0.04 0.01 -0.26 0.00 -1.27 0.00 0.00 60.65 59.09 1cdn h LYS 12 Cb 0.35 0.02 0.02 0.00 -0.41 0.00 0.00 32.23 32.22 1cdn h LYS 12 CO 0.06 -0.07 -1.05 1.88 -2.27 0.00 0.00 179.45 178.00 1cdn h TYR 13 N -0.11 0.90 0.77 1.91 0.05 -0.80 -3.32 116.97 116.37 1cdn h TYR 13 Ca 0.27 -0.55 -0.03 0.00 0.05 0.00 0.00 58.73 58.47 1cdn h TYR 13 Cb 0.56 -0.08 -0.00 0.00 1.01 0.00 0.00 36.73 38.22 1cdn h TYR 13 CO -0.69 1.39 -0.44 0.00 -1.05 0.00 0.00 178.16 177.37 1cdn h ALA 14 N 0.29 -1.14 -0.92 3.88 0.00 -0.49 -3.23 119.26 117.65 1cdn h ALA 14 Ca -0.16 -0.23 0.25 0.00 0.00 0.00 0.00 54.91 54.77 1cdn h ALA 14 Cb 1.75 0.52 -0.05 0.00 0.00 0.00 0.00 17.79 20.00 1cdn h ALA 14 CO 0.20 -1.15 0.64 0.00 0.00 0.00 0.00 179.25 178.94 1cdn h ALA 15 N -0.95 2.60 -0.43 0.00 0.00 -0.94 0.23 119.26 119.76 1cdn h ALA 15 Ca -0.10 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.89 1cdn h ALA 15 Cb 0.89 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1cdn h ALA 15 CO 0.13 -0.88 0.30 0.87 0.00 0.00 0.00 179.25 179.66 1cdn h LYS 16 N 0.16 0.19 0.00 0.00 1.57 -1.65 -3.39 116.57 113.44 1cdn h LYS 16 Ca 0.46 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.23 1cdn h LYS 16 Cb 1.54 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.81 1cdn h LYS 16 CO -0.09 0.13 -0.00 -1.91 -0.57 0.00 0.00 179.45 177.01 1cdn n GLU 17 N -4.46 0.00 -4.02 3.15 2.13 -0.27 -5.14 120.64 112.03 1cdn n GLU 17 Ca 0.07 0.00 -0.28 0.00 0.66 0.00 0.00 57.16 57.61 1cdn n GLU 17 Cb 0.37 -0.38 -0.01 0.00 0.27 0.00 0.00 31.44 31.68 1cdn n GLU 17 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1cdn s GLY 18 N -3.49 2.49 0.27 8.31 0.00 0.65 -5.08 107.32 110.46 1cdn s GLY 18 Ca 0.00 -1.04 -0.30 0.00 0.00 0.00 0.00 44.72 43.38 1cdn s GLY 18 CO 0.00 -1.99 1.60 -0.35 0.00 0.00 0.00 173.10 172.36 1cdn s ASP 19 N -4.24 6.40 0.61 1.64 -1.08 -1.25 -3.94 116.67 114.80 1cdn s ASP 19 Ca 0.28 2.90 0.29 0.00 -0.52 0.00 0.00 52.55 55.50 1cdn s ASP 19 Cb -0.02 -2.63 1.51 0.00 -1.46 0.00 0.00 42.92 40.32 1cdn s ASP 19 CO 0.18 -0.90 1.91 1.55 0.52 0.00 0.00 175.17 178.42 1cdn h PRO 20 N 5.28 0.00 -0.01 4.34 0.13 -1.91 0.04 132.00 139.87 1cdn h PRO 20 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1cdn h PRO 20 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1cdn h PRO 20 CO 0.83 0.00 -0.24 0.09 -0.23 0.00 0.00 178.00 178.45 1cdn n ASN 21 N -3.54 0.78 -3.65 1.44 3.02 -1.26 -4.41 115.26 107.65 1cdn n ASN 21 Ca 0.06 -0.69 -0.12 0.00 -0.03 0.00 0.00 54.58 53.80 1cdn n ASN 21 Cb 0.59 0.07 -0.12 0.00 -0.61 0.00 0.00 39.78 39.71 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 -2.57 0.21 -0.02 3.52 0.74 -0.00 -1.55 119.66 119.99 1cdn s GLN 22 Ca 0.24 0.83 -0.20 0.00 0.05 0.00 0.00 55.36 56.27 1cdn s GLN 22 Cb 0.19 0.05 -0.05 0.00 1.10 0.00 0.00 33.01 34.30 1cdn s GLN 22 CO 0.53 -0.29 0.59 -0.51 -0.55 0.00 0.00 175.29 175.06 1cdn s LEU 23 N 2.48 4.39 0.89 3.68 1.43 0.36 -3.96 118.68 127.95 1cdn s LEU 23 Ca 0.01 1.12 -0.13 0.00 -1.03 0.00 0.00 54.13 54.10 1cdn s LEU 23 Cb -0.12 -2.91 0.13 0.00 0.03 0.00 0.00 46.19 43.32 1cdn s LEU 23 CO -0.10 0.07 1.19 -0.94 0.23 0.00 0.00 176.35 176.79 1cdn s SER 24 N 0.00 3.77 0.16 2.29 1.04 -1.26 -0.70 113.70 119.00 1cdn s SER 24 Ca 0.31 0.75 -0.16 0.00 0.48 0.00 0.00 55.95 57.33 1cdn s SER 24 Cb -0.18 -1.18 0.06 0.00 0.10 0.00 0.00 66.02 64.82 1cdn s SER 24 CO 0.16 -2.37 1.78 0.11 0.98 0.00 0.00 173.24 173.91 1cdn h LYS 25 N -1.38 0.39 -0.38 4.02 1.57 -1.98 -0.18 116.57 118.62 1cdn h LYS 25 Ca -0.47 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.24 1cdn h LYS 25 Cb 1.31 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.52 1cdn h LYS 25 CO 0.58 0.26 0.07 1.49 -0.57 0.00 0.00 179.45 181.28 1cdn h GLU 26 N 0.40 0.63 -0.24 3.15 4.57 -1.98 0.27 114.58 121.38 1cdn h GLU 26 Ca 0.17 -0.17 0.04 0.00 -1.18 0.00 0.00 59.36 58.22 1cdn h GLU 26 Cb 0.08 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 1cdn h GLU 26 CO -0.12 0.68 -0.01 0.93 -1.18 0.00 0.00 179.01 179.31 1cdn h GLU 27 N 0.48 0.05 -0.86 1.92 5.08 -1.83 0.39 114.58 119.81 1cdn h GLU 27 Ca 0.12 -0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.56 1cdn h GLU 27 Cb 0.35 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.52 1cdn h GLU 27 CO 0.01 0.03 0.51 -0.07 -1.00 0.00 0.00 179.01 178.49 1cdn h LEU 28 N 0.05 0.76 0.32 1.33 3.38 -0.64 0.13 115.31 120.65 1cdn h LEU 28 Ca 0.11 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1cdn h LEU 28 Cb 0.15 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1cdn h LEU 28 CO -0.20 0.45 -0.16 0.50 0.09 0.00 0.00 178.44 179.11 1cdn h LYS 29 N 0.88 -0.43 -0.38 1.13 3.64 0.74 0.26 116.57 122.41 1cdn h LYS 29 Ca 0.40 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.84 1cdn h LYS 29 Cb 0.31 0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 1cdn h LYS 29 CO -0.23 -0.29 0.20 -0.07 -2.27 0.00 0.00 179.45 176.80 1cdn h LEU 30 N -0.45 0.30 -0.01 5.20 3.38 -0.77 0.10 115.31 123.07 1cdn h LEU 30 Ca -0.04 0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.97 1cdn h LEU 30 Cb 0.35 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 1cdn h LEU 30 CO 0.07 0.22 -0.43 0.25 0.09 0.00 0.00 178.44 178.63 1cdn h LEU 31 N 0.40 -1.33 0.12 1.67 6.46 -0.74 -0.66 115.31 121.25 1cdn h LEU 31 Ca 0.16 0.16 0.02 0.00 -0.12 0.00 0.00 57.88 58.10 1cdn h LEU 31 Cb 0.06 0.52 -0.04 0.00 -0.73 0.00 0.00 40.66 40.47 1cdn h LEU 31 CO -0.11 -0.47 -0.30 -0.07 -0.62 0.00 0.00 178.44 176.88 1cdn h LEU 32 N -0.58 -0.85 -0.28 2.25 3.38 -0.10 0.37 115.31 119.50 1cdn h LEU 32 Ca 0.04 0.10 0.06 0.00 0.09 0.00 0.00 57.88 58.17 1cdn h LEU 32 Cb 0.66 0.32 -0.06 0.00 0.09 0.00 0.00 40.66 41.67 1cdn h LEU 32 CO -0.33 -0.39 -0.13 1.56 0.09 0.00 0.00 178.44 179.25 1cdn h GLN 33 N -0.52 -0.08 0.04 1.13 4.20 -0.60 0.18 115.11 119.46 1cdn h GLN 33 Ca 0.03 0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 1cdn h GLN 33 Cb 0.55 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.34 1cdn h GLN 33 CO -0.17 -0.05 -0.02 1.15 -0.67 0.00 0.00 178.83 179.06 1cdn h THR 34 N -0.09 1.36 0.00 -0.54 2.02 -0.89 -3.38 112.91 111.41 1cdn h THR 34 Ca 0.15 -1.49 -0.31 0.00 0.77 0.00 0.00 66.41 65.53 1cdn h THR 34 Cb 0.31 2.32 -0.06 0.00 -1.74 0.00 0.00 68.15 68.98 1cdn h THR 34 CO -0.34 0.37 -1.98 -0.62 0.37 0.00 0.00 175.52 173.32 1cdn n GLU 35 N -4.80 0.66 -3.20 6.66 -0.58 0.10 -4.70 120.64 114.78 1cdn n GLU 35 Ca -0.09 0.16 -0.23 0.00 -0.42 0.00 0.00 57.16 56.59 1cdn n GLU 35 Cb 0.32 -1.68 -0.06 0.00 -0.57 0.00 0.00 31.44 29.45 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 -2.90 0.45 -0.28 -0.32 3.72 0.62 -4.91 117.46 113.84 1cdn n PHE 36 Ca -0.23 -3.72 0.31 0.00 -0.05 0.00 0.00 57.45 53.75 1cdn n PHE 36 Cb 1.08 -0.40 0.69 0.00 -0.94 0.00 0.00 39.48 39.91 1cdn n PHE 36 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1cdn h PRO 37 N 3.67 0.09 0.58 -1.08 0.11 -1.70 -0.16 132.00 133.50 1cdn h PRO 37 Ca 0.10 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.18 1cdn h PRO 37 Cb 0.86 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.94 1cdn h PRO 37 CO 0.53 0.06 -0.48 0.66 -0.21 0.00 0.00 178.00 178.55 1cdn h SER 38 N 0.09 -1.29 -0.90 -2.05 4.64 -1.91 0.86 113.55 112.99 1cdn h SER 38 Ca 0.53 0.09 0.06 0.00 -0.47 0.00 0.00 61.79 62.00 1cdn h SER 38 Cb 1.94 0.41 -0.06 0.00 -0.31 0.00 0.00 62.40 64.37 1cdn h SER 38 CO -0.07 -0.67 0.57 -0.07 -0.87 0.00 0.00 176.83 175.72 1cdn h LEU 39 N -1.04 0.91 -0.39 5.97 3.38 -1.63 0.13 115.31 122.65 1cdn h LEU 39 Ca -0.08 0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.95 1cdn h LEU 39 Cb 0.87 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 1cdn h LEU 39 CO -0.00 0.59 0.16 0.25 0.09 0.00 0.00 178.44 179.52 1cdn h LEU 40 N 1.05 0.19 -0.68 1.67 5.85 -0.72 -2.16 115.31 120.51 1cdn h LEU 40 Ca 0.39 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 59.04 1cdn h LEU 40 Cb 0.15 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1cdn h LEU 40 CO -0.17 0.15 -0.10 0.11 -0.34 0.00 0.00 178.44 178.09 1cdn h LYS 41 N 0.33 0.93 -5.04 1.25 1.57 -0.39 -3.45 116.57 111.77 1cdn h LYS 41 Ca 0.17 -0.32 -0.72 0.00 -1.87 0.00 0.00 60.65 57.91 1cdn h LYS 41 Cb 0.13 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1cdn h LYS 41 CO -0.16 0.98 0.66 0.41 -0.57 0.00 0.00 179.45 180.77 1cdn n GLY 42 N -0.36 0.11 3.34 3.86 0.00 0.42 -4.73 105.19 107.84 1cdn n GLY 42 Ca 0.02 0.86 -0.37 0.00 0.00 0.00 0.00 46.02 46.53 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 3.83 1.57 3.55 -0.02 0.00 -1.26 -4.73 105.19 108.12 1cdn n GLY 43 Ca 0.29 -0.94 -0.15 0.00 0.00 0.00 0.00 46.02 45.22 1cdn n GLY 43 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cdn s SER 44 N 6.00 -0.67 0.78 1.61 0.01 -1.26 -5.16 113.70 115.02 1cdn s SER 44 Ca 0.64 1.17 -0.11 0.00 1.31 0.00 0.00 55.95 58.96 1cdn s SER 44 Cb 0.08 1.15 0.06 0.00 0.21 0.00 0.00 66.02 67.53 1cdn s SER 44 CO 0.16 -0.32 1.09 0.42 0.41 0.00 0.00 173.24 175.00 1cdn s THR 45 N -0.05 3.29 0.22 1.44 -4.23 -1.26 -4.82 115.64 110.23 1cdn s THR 45 Ca -0.03 0.42 -0.08 0.00 -1.18 0.00 0.00 61.69 60.82 1cdn s THR 45 Cb -0.04 -2.94 0.17 0.00 1.34 0.00 0.00 72.50 71.03 1cdn s THR 45 CO 0.03 -0.55 1.79 -0.07 -0.54 0.00 0.00 174.62 175.28 1cdn h LEU 46 N -1.15 0.50 -0.17 4.79 3.38 -1.96 0.10 115.31 120.79 1cdn h LEU 46 Ca -0.45 0.05 0.02 0.00 0.09 0.00 0.00 57.88 57.59 1cdn h LEU 46 Cb 1.24 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 1cdn h LEU 46 CO 0.53 0.30 0.04 0.44 0.09 0.00 0.00 178.44 179.84 1cdn h ASP 47 N 0.63 0.03 -0.05 -0.43 5.19 -1.98 0.24 116.42 120.06 1cdn h ASP 47 Ca 0.33 0.02 0.02 0.00 -0.62 0.00 0.00 57.03 56.78 1cdn h ASP 47 Cb 0.31 0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.82 1cdn h ASP 47 CO -0.24 0.04 -0.06 -0.33 -3.12 0.00 0.00 179.24 175.54 1cdn h GLU 48 N 0.12 -0.08 -0.27 3.56 5.08 -1.74 0.98 114.58 122.23 1cdn h GLU 48 Ca 0.07 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.47 1cdn h GLU 48 Cb 0.06 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 1cdn h GLU 48 CO -0.09 -0.05 0.08 -0.07 -1.00 0.00 0.00 179.01 177.89 1cdn h LEU 49 N -0.08 0.08 0.00 1.33 3.38 -0.70 0.95 115.31 120.28 1cdn h LEU 49 Ca 0.04 0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.07 1cdn h LEU 49 Cb 0.13 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 1cdn h LEU 49 CO -0.09 0.08 -0.21 0.15 0.09 0.00 0.00 178.44 178.46 1cdn h PHE 50 N 0.20 -0.56 -0.50 1.13 3.57 -0.30 -0.25 116.94 120.24 1cdn h PHE 50 Ca 0.12 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.68 1cdn h PHE 50 Cb 0.09 0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 1cdn h PHE 50 CO -0.13 -0.30 0.26 1.49 -2.23 0.00 0.00 178.31 177.40 1cdn h GLU 51 N -0.34 0.50 -0.53 1.11 4.81 -0.45 0.24 114.58 119.92 1cdn h GLU 51 Ca 0.06 -0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1cdn h GLU 51 Cb 0.41 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 29.63 1cdn h GLU 51 CO -0.19 0.33 0.23 1.49 -0.73 0.00 0.00 179.01 180.14 1cdn h GLU 52 N 0.51 0.43 0.12 1.92 4.22 -0.26 -3.05 114.58 118.46 1cdn h GLU 52 Ca 0.22 -0.03 -0.29 0.00 0.08 0.00 0.00 59.36 59.34 1cdn h GLU 52 Cb 0.11 -0.10 0.02 0.00 0.50 0.00 0.00 28.75 29.29 1cdn h GLU 52 CO -0.14 0.28 -1.23 -0.07 -2.18 0.00 0.00 179.01 175.67 1cdn h LEU 53 N 0.44 0.73 -7.02 1.64 3.38 -0.46 -3.39 115.31 110.62 1cdn h LEU 53 Ca 0.25 -0.69 -0.53 0.00 0.09 0.00 0.00 57.88 57.00 1cdn h LEU 53 Cb 0.22 -0.23 0.05 0.00 0.09 0.00 0.00 40.66 40.79 1cdn h LEU 53 CO -0.21 1.51 1.68 -0.67 0.09 0.00 0.00 178.44 180.84 1cdn n ASP 54 N -3.72 2.23 -4.54 -0.43 2.03 0.79 -4.62 116.55 108.29 1cdn n ASP 54 Ca -0.12 -2.63 -0.36 0.00 0.52 0.00 0.00 54.79 52.20 1cdn n ASP 54 Cb 0.99 -1.16 -0.05 0.00 -0.72 0.00 0.00 41.12 40.18 1cdn n ASP 54 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1cdn n LYS 55 N 7.56 0.89 -0.21 -0.67 4.76 -1.26 -0.87 118.16 128.36 1cdn n LYS 55 Ca 0.47 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.89 1cdn n LYS 55 Cb 0.43 -3.20 0.00 0.00 -1.84 0.00 0.00 35.03 30.42 1cdn n LYS 55 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 1cdn n ASN 56 N 15.31 -0.34 -1.25 4.39 0.23 -1.26 -4.44 115.26 127.89 1cdn n ASN 56 Ca 0.41 0.00 -0.01 0.00 -0.53 0.00 0.00 54.58 54.45 1cdn n ASN 56 Cb 0.48 -0.06 0.00 0.00 -2.08 0.00 0.00 39.78 38.12 1cdn n ASN 56 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1cdn n GLY 57 N -2.11 0.53 0.09 4.83 0.00 -0.05 -5.00 105.19 103.48 1cdn n GLY 57 Ca 0.00 -0.39 -0.15 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.07 0.15 0.00 1.61 3.04 -1.78 -3.50 116.42 115.87 1cdn h ASP 58 Ca -0.03 -0.85 0.00 0.00 -3.24 0.00 0.00 57.03 52.92 1cdn h ASP 58 Cb 1.01 -0.05 0.00 0.00 -1.04 0.00 0.00 39.33 39.26 1cdn h ASP 58 CO 0.02 0.98 0.00 0.61 -2.04 0.00 0.00 179.24 178.82 1cdn n GLY 59 N 1.24 -1.20 3.91 7.15 0.00 -1.26 -5.13 105.19 109.90 1cdn n GLY 59 Ca -0.10 0.42 -0.31 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 3.53 -0.47 1.61 2.02 -1.26 -4.88 118.70 119.25 1cdn s GLU 60 Ca 0.00 -0.27 -0.26 0.00 0.02 0.00 0.00 54.97 54.46 1cdn s GLU 60 Cb 0.00 -2.95 0.03 0.00 0.10 0.00 0.00 34.13 31.31 1cdn s GLU 60 CO 0.00 0.54 0.98 0.08 0.02 0.00 0.00 175.26 176.88 1cdn s VAL 61 N -1.59 4.40 0.52 2.63 1.01 0.12 -4.75 120.40 122.75 1cdn s VAL 61 Ca 0.38 0.84 -0.17 0.00 0.00 0.00 0.00 61.98 63.02 1cdn s VAL 61 Cb -0.13 -4.49 -0.07 0.00 0.00 0.00 0.00 36.38 31.70 1cdn s VAL 61 CO 0.26 -0.90 1.01 -0.44 0.00 0.00 0.00 175.10 175.03 1cdn s SER 62 N 2.35 6.39 0.31 3.32 0.01 -1.26 -0.49 113.70 124.33 1cdn s SER 62 Ca 0.39 1.70 0.03 0.00 1.31 0.00 0.00 55.95 59.38 1cdn s SER 62 Cb -0.09 -2.53 0.63 0.00 0.21 0.00 0.00 66.02 64.24 1cdn s SER 62 CO 0.27 -0.75 1.87 0.15 0.41 0.00 0.00 173.24 175.20 1cdn h PHE 63 N 0.97 1.01 0.91 2.43 3.57 -1.66 0.87 116.94 125.05 1cdn h PHE 63 Ca -0.47 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.01 1cdn h PHE 63 Cb 1.20 -0.32 0.01 0.00 2.79 0.00 0.00 35.95 39.62 1cdn h PHE 63 CO 0.61 0.43 -0.44 1.49 -2.23 0.00 0.00 178.31 178.18 1cdn h GLU 64 N 0.91 -1.18 -0.65 1.11 4.57 -1.93 -2.72 114.58 114.69 1cdn h GLU 64 Ca 0.45 0.08 0.02 0.00 -1.18 0.00 0.00 59.36 58.73 1cdn h GLU 64 Cb 0.47 0.27 -0.03 0.00 -0.16 0.00 0.00 28.75 29.29 1cdn h GLU 64 CO -0.21 -0.79 0.43 1.05 -1.18 0.00 0.00 179.01 178.31 1cdn h GLU 65 N -1.32 0.80 -0.50 1.92 4.11 -1.80 0.74 114.58 118.52 1cdn h GLU 65 Ca -0.13 -0.05 0.15 0.00 0.07 0.00 0.00 59.36 59.40 1cdn h GLU 65 Cb 0.94 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 1cdn h GLU 65 CO 0.21 0.53 0.51 0.35 0.07 0.00 0.00 179.01 180.68 1cdn h PHE 66 N 0.82 0.00 -0.53 2.06 3.57 -0.72 0.23 116.94 122.37 1cdn h PHE 66 Ca 0.25 0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.90 1cdn h PHE 66 Cb -0.00 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 1cdn h PHE 66 CO -0.00 0.00 0.46 1.96 -2.23 0.00 0.00 178.31 178.50 1cdn h GLN 67 N 0.00 0.00 -0.41 1.11 1.08 -0.52 0.26 115.11 116.63 1cdn h GLN 67 Ca 0.24 0.00 0.11 0.00 -1.45 0.00 0.00 58.65 57.55 1cdn h GLN 67 Cb 1.26 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.67 1cdn h GLN 67 CO -0.00 0.00 0.29 0.28 -0.95 0.00 0.00 178.83 178.45 1cdn h VAL 68 N 0.00 0.82 0.01 -0.54 2.07 -1.12 -0.16 116.25 117.33 1cdn h VAL 68 Ca 0.25 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.75 1cdn h VAL 68 Cb 1.16 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1cdn h VAL 68 CO -0.00 0.01 -0.01 0.25 0.02 0.00 0.00 177.57 177.84 1cdn h LEU 69 N 0.06 -0.01 -0.85 2.57 5.85 -0.68 -3.36 115.31 118.90 1cdn h LEU 69 Ca 0.20 -0.79 0.20 0.00 0.84 0.00 0.00 57.88 58.33 1cdn h LEU 69 Cb 0.70 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 41.61 1cdn h LEU 69 CO -0.01 0.84 0.30 0.58 -0.34 0.00 0.00 178.44 179.81 1cdn h VAL 70 N -0.93 0.46 -0.87 1.05 2.07 -0.76 0.15 116.25 117.41 1cdn h VAL 70 Ca -0.00 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.42 1cdn h VAL 70 Cb 0.80 0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 1cdn h VAL 70 CO 0.00 0.06 0.58 0.07 0.02 0.00 0.00 177.57 178.30 1cdn h LYS 71 N 0.33 1.15 -0.45 1.57 2.10 -1.24 0.15 116.57 120.18 1cdn h LYS 71 Ca 0.52 -0.07 0.00 0.00 -2.00 0.00 0.00 60.65 59.10 1cdn h LYS 71 Cb 0.96 -0.26 -0.02 0.00 -0.90 0.00 0.00 32.23 32.01 1cdn h LYS 71 CO -0.55 0.76 0.28 0.87 -2.00 0.00 0.00 179.45 178.81 1cdn h LYS 72 N 1.18 0.60 0.41 0.07 6.56 -0.91 0.20 116.57 124.68 1cdn h LYS 72 Ca 0.32 -0.05 -0.02 0.00 -1.06 0.00 0.00 60.65 59.84 1cdn h LYS 72 Cb -0.13 -0.13 0.00 0.00 -0.57 0.00 0.00 32.23 31.41 1cdn h LYS 72 CO -0.07 0.43 -0.20 0.82 -2.06 0.00 0.00 179.45 178.37 1cdn h ILE 73 N 0.60 0.60 0.00 1.86 2.04 -0.13 -3.41 117.51 119.07 1cdn h ILE 73 Ca 0.16 -0.09 -0.23 0.00 1.00 0.00 0.00 64.86 65.70 1cdn h ILE 73 Cb -0.03 0.65 -0.15 0.00 -0.74 0.00 0.00 36.82 36.56 1cdn h ILE 73 CO -0.03 0.02 -0.39 -1.20 0.00 0.00 0.00 178.15 176.55 1cdn n SER 74 N -5.30 -2.17 0.00 1.72 7.64 0.42 -4.61 113.62 111.31 1cdn n SER 74 Ca -0.11 -3.27 0.00 0.00 1.01 0.00 0.00 58.87 56.50 1cdn n SER 74 Cb 0.25 1.64 0.00 0.00 -1.01 0.00 0.00 64.21 65.09 1cdn n SER 74 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03