#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 5.07 0.34 4.39 1.04 -1.26 -4.81 113.70 118.48 1cdn s SER 2 Ca 0.00 2.05 0.13 0.00 0.48 0.00 0.00 55.95 58.61 1cdn s SER 2 Cb 0.00 -2.56 1.02 0.00 0.10 0.00 0.00 66.02 64.58 1cdn s SER 2 CO 0.00 -1.66 1.70 -0.65 0.98 0.00 0.00 173.24 173.61 1cdn h PRO 3 N 0.09 0.42 -0.07 4.02 0.11 -2.05 0.78 132.00 135.30 1cdn h PRO 3 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1cdn h PRO 3 Cb 1.25 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1cdn h PRO 3 CO 0.54 0.28 0.04 0.93 -0.21 0.00 0.00 178.00 179.58 1cdn h GLU 4 N 0.43 0.09 -0.46 1.05 3.07 -1.99 0.26 114.58 117.03 1cdn h GLU 4 Ca 0.69 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.55 1cdn h GLU 4 Cb 1.51 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.38 1cdn h GLU 4 CO -0.52 0.06 0.30 0.93 -1.40 0.00 0.00 179.01 178.37 1cdn h GLU 5 N 0.09 0.60 -0.57 2.33 5.08 -1.46 -0.35 114.58 120.31 1cdn h GLU 5 Ca 0.03 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1cdn h GLU 5 Cb -0.00 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1cdn h GLU 5 CO -0.01 0.41 0.28 -0.07 -1.00 0.00 0.00 179.01 178.62 1cdn h LEU 6 N 0.62 0.70 -0.05 1.33 3.38 -0.60 0.15 115.31 120.84 1cdn h LEU 6 Ca 0.17 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1cdn h LEU 6 Cb -0.06 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1cdn h LEU 6 CO -0.04 0.59 0.03 0.50 0.09 0.00 0.00 178.44 179.61 1cdn h LYS 7 N 0.79 0.07 -0.39 1.13 1.63 -0.03 0.21 116.57 119.98 1cdn h LYS 7 Ca 0.20 -0.01 0.08 0.00 -0.85 0.00 0.00 60.65 60.07 1cdn h LYS 7 Cb 0.06 -0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 31.60 1cdn h LYS 7 CO -0.03 0.11 -0.18 0.78 -3.45 0.00 0.00 179.45 176.68 1cdn h GLY 8 N 0.01 0.12 0.72 5.01 0.00 0.06 0.11 103.07 109.10 1cdn h GLY 8 Ca 0.02 0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 1cdn h GLY 8 CO -0.00 -0.19 -0.29 -2.22 0.00 0.00 0.00 176.54 173.83 1cdn h ILE 9 N -0.10 0.38 -0.60 2.60 1.08 -0.66 0.86 117.51 121.07 1cdn h ILE 9 Ca 0.19 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.78 1cdn h ILE 9 Cb 0.40 0.38 -0.12 0.00 -3.07 0.00 0.00 36.82 34.42 1cdn h ILE 9 CO -0.46 0.00 -0.26 0.15 -0.69 0.00 0.00 178.15 176.90 1cdn h PHE 10 N -0.65 -0.65 0.08 1.37 3.04 0.07 -0.84 116.94 119.36 1cdn h PHE 10 Ca -0.02 0.06 -0.00 0.00 3.98 0.00 0.00 57.97 61.99 1cdn h PHE 10 Cb 0.58 0.38 0.00 0.00 2.56 0.00 0.00 35.95 39.47 1cdn h PHE 10 CO -0.16 -0.34 -0.04 0.93 -2.02 0.00 0.00 178.31 176.68 1cdn h GLU 11 N -0.10 -0.10 -0.74 1.11 5.08 -0.53 0.16 114.58 119.47 1cdn h GLU 11 Ca 0.27 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.76 1cdn h GLU 11 Cb 0.52 0.02 -0.13 0.00 0.50 0.00 0.00 28.75 29.66 1cdn h GLU 11 CO -0.67 0.04 -0.34 -0.22 -1.00 0.00 0.00 179.01 176.83 1cdn h LYS 12 N -0.23 -0.09 0.04 2.33 3.64 0.13 0.99 116.57 123.38 1cdn h LYS 12 Ca -0.01 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 1cdn h LYS 12 Cb 0.19 0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1cdn h LYS 12 CO 0.02 -0.06 -0.32 1.88 -2.27 0.00 0.00 179.45 178.70 1cdn h TYR 13 N -0.10 0.25 -0.84 1.91 0.05 -1.06 -3.29 116.97 113.89 1cdn h TYR 13 Ca 0.28 -0.16 0.14 0.00 0.05 0.00 0.00 58.73 59.03 1cdn h TYR 13 Cb 0.57 -0.02 -0.09 0.00 1.01 0.00 0.00 36.73 38.20 1cdn h TYR 13 CO -0.71 1.06 0.44 0.00 -1.05 0.00 0.00 178.16 177.90 1cdn h ALA 14 N 0.13 1.25 0.00 3.88 0.00 -0.39 0.80 119.26 124.93 1cdn h ALA 14 Ca -0.05 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1cdn h ALA 14 Cb 1.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1cdn h ALA 14 CO 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.26 1cdn h ALA 15 N 1.54 1.00 -0.61 0.00 0.00 -0.91 -2.96 119.26 117.31 1cdn h ALA 15 Ca 0.45 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 55.00 1cdn h ALA 15 Cb 0.59 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1cdn h ALA 15 CO -0.34 0.00 1.07 0.21 0.00 0.00 0.00 179.25 180.19 1cdn s LYS 16 N -3.57 2.68 0.00 0.00 2.20 0.27 -4.15 119.74 117.18 1cdn s LYS 16 Ca 0.01 -0.95 0.00 0.00 -0.36 0.00 0.00 55.97 54.67 1cdn s LYS 16 Cb 0.09 -5.21 0.00 0.00 -1.51 0.00 0.00 37.83 31.19 1cdn s LYS 16 CO 0.38 -3.57 0.00 0.39 -0.36 0.00 0.00 175.35 172.18 1cdn n GLU 17 N 8.50 0.00 -0.90 4.03 1.02 -1.26 -4.90 120.64 127.13 1cdn n GLU 17 Ca 0.43 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 57.27 1cdn n GLU 17 Cb 0.47 -0.31 0.24 0.00 -0.02 0.00 0.00 31.44 31.82 1cdn n GLU 17 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1cdn s GLY 18 N 0.00 1.54 0.13 0.62 0.00 -1.12 -5.02 107.32 103.47 1cdn s GLY 18 Ca 0.00 -0.77 -0.30 0.00 0.00 0.00 0.00 44.72 43.66 1cdn s GLY 18 CO 0.00 0.09 0.94 -0.35 0.00 0.00 0.00 173.10 173.79 1cdn s ASP 19 N -3.55 7.51 0.59 1.64 -1.08 -1.19 -4.17 116.67 116.43 1cdn s ASP 19 Ca 0.69 1.80 0.29 0.00 -0.52 0.00 0.00 52.55 54.81 1cdn s ASP 19 Cb -0.13 -2.58 1.48 0.00 -1.46 0.00 0.00 42.92 40.23 1cdn s ASP 19 CO 0.57 -0.01 1.90 1.55 0.52 0.00 0.00 175.17 179.71 1cdn h PRO 20 N 5.27 0.00 -0.00 4.34 0.13 -1.88 0.28 132.00 140.15 1cdn h PRO 20 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1cdn h PRO 20 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1cdn h PRO 20 CO 0.71 0.00 -0.16 0.09 -0.23 0.00 0.00 178.00 178.41 1cdn n ASN 21 N -3.70 0.42 -3.62 1.44 3.02 -1.26 -4.39 115.26 107.17 1cdn n ASN 21 Ca 0.08 -0.37 -0.08 0.00 -0.03 0.00 0.00 54.58 54.17 1cdn n ASN 21 Cb 0.65 -0.08 -0.09 0.00 -0.61 0.00 0.00 39.78 39.65 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 -2.63 0.33 -0.01 3.52 0.74 0.09 -3.64 119.66 118.05 1cdn s GLN 22 Ca 0.24 0.97 -0.26 0.00 0.05 0.00 0.00 55.36 56.36 1cdn s GLN 22 Cb 0.19 0.24 -0.04 0.00 1.10 0.00 0.00 33.01 34.50 1cdn s GLN 22 CO 0.52 -0.30 0.82 -0.51 -0.55 0.00 0.00 175.29 175.26 1cdn s LEU 23 N 2.61 4.38 0.92 3.68 1.43 0.36 -3.92 118.68 128.14 1cdn s LEU 23 Ca 0.00 1.43 -0.15 0.00 -1.03 0.00 0.00 54.13 54.39 1cdn s LEU 23 Cb -0.12 -3.30 0.17 0.00 0.03 0.00 0.00 46.19 42.96 1cdn s LEU 23 CO -0.13 -0.13 1.28 -0.94 0.23 0.00 0.00 176.35 176.66 1cdn s SER 24 N 0.62 3.47 0.24 2.29 1.04 -1.26 -0.91 113.70 119.18 1cdn s SER 24 Ca 0.43 0.43 -0.06 0.00 0.48 0.00 0.00 55.95 57.23 1cdn s SER 24 Cb -0.20 -0.61 0.32 0.00 0.10 0.00 0.00 66.02 65.64 1cdn s SER 24 CO 0.23 -2.53 1.85 0.11 0.98 0.00 0.00 173.24 173.88 1cdn h LYS 25 N -1.50 0.92 0.18 4.02 1.57 -1.98 -0.08 116.57 119.70 1cdn h LYS 25 Ca -0.45 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.27 1cdn h LYS 25 Cb 1.26 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1cdn h LYS 25 CO 0.46 0.61 -0.09 0.93 -0.57 0.00 0.00 179.45 180.79 1cdn h GLU 26 N 0.95 -0.24 -0.86 3.15 3.07 -1.99 0.26 114.58 118.93 1cdn h GLU 26 Ca 0.37 0.02 0.04 0.00 -0.50 0.00 0.00 59.36 59.28 1cdn h GLU 26 Cb 0.17 0.05 -0.05 0.00 -0.84 0.00 0.00 28.75 28.08 1cdn h GLU 26 CO -0.17 -0.01 0.55 0.93 -1.40 0.00 0.00 179.01 178.90 1cdn h GLU 27 N -0.43 1.03 -0.71 2.33 3.07 -1.86 0.83 114.58 118.85 1cdn h GLU 27 Ca -0.03 -0.06 0.07 0.00 -0.50 0.00 0.00 59.36 58.84 1cdn h GLU 27 Cb 0.33 -0.23 -0.06 0.00 -0.84 0.00 0.00 28.75 27.95 1cdn h GLU 27 CO 0.04 0.68 0.39 -0.07 -1.40 0.00 0.00 179.01 178.65 1cdn h LEU 28 N 1.06 0.56 -0.36 1.33 3.38 -0.68 0.62 115.31 121.22 1cdn h LEU 28 Ca 0.35 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.35 1cdn h LEU 28 Cb 0.03 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1cdn h LEU 28 CO -0.13 0.35 0.19 0.50 0.09 0.00 0.00 178.44 179.44 1cdn h LYS 29 N 0.70 0.51 0.09 1.13 3.64 0.17 0.31 116.57 123.13 1cdn h LYS 29 Ca 0.32 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1cdn h LYS 29 Cb 0.24 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1cdn h LYS 29 CO -0.21 0.44 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.30 1cdn h LEU 30 N 0.45 -0.11 -0.14 5.20 -0.00 -0.80 -0.14 115.31 119.77 1cdn h LEU 30 Ca 0.13 -0.00 0.05 0.00 -0.00 0.00 0.00 57.88 58.05 1cdn h LEU 30 Cb 0.09 0.03 -0.06 0.00 -0.00 0.00 0.00 40.66 40.71 1cdn h LEU 30 CO -0.02 -0.07 -0.33 0.25 -0.00 0.00 0.00 178.44 178.27 1cdn h LEU 31 N -0.13 -1.03 0.29 1.67 6.46 -0.58 -0.51 115.31 121.47 1cdn h LEU 31 Ca -0.01 0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1cdn h LEU 31 Cb 0.10 0.44 -0.03 0.00 -0.73 0.00 0.00 40.66 40.45 1cdn h LEU 31 CO 0.02 -0.36 -0.34 -0.07 -0.62 0.00 0.00 178.44 177.06 1cdn h LEU 32 N -0.40 -0.94 -0.12 2.25 3.38 -0.27 0.14 115.31 119.35 1cdn h LEU 32 Ca 0.10 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.19 1cdn h LEU 32 Cb 0.55 0.33 -0.04 0.00 0.09 0.00 0.00 40.66 41.59 1cdn h LEU 32 CO -0.37 -0.47 -0.13 1.56 0.09 0.00 0.00 178.44 179.13 1cdn h GLN 33 N -0.68 -0.16 -0.08 1.13 4.20 -0.79 0.19 115.11 118.92 1cdn h GLN 33 Ca -0.01 0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 1cdn h GLN 33 Cb 0.63 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1cdn h GLN 33 CO -0.10 -0.10 -0.30 1.15 -0.67 0.00 0.00 178.83 178.81 1cdn h THR 34 N -0.16 1.41 0.01 -0.54 2.02 -0.89 -3.34 112.91 111.43 1cdn h THR 34 Ca 0.09 -1.67 -0.39 0.00 0.77 0.00 0.00 66.41 65.21 1cdn h THR 34 Cb 0.28 2.26 -0.06 0.00 -1.74 0.00 0.00 68.15 68.89 1cdn h THR 34 CO -0.21 0.48 -2.42 -0.62 0.37 0.00 0.00 175.52 173.12 1cdn n GLU 35 N -4.44 0.66 -2.86 6.66 -0.58 0.46 -4.73 120.64 115.82 1cdn n GLU 35 Ca -0.08 0.15 -0.23 0.00 -0.42 0.00 0.00 57.16 56.58 1cdn n GLU 35 Cb 0.48 -1.54 -0.02 0.00 -0.57 0.00 0.00 31.44 29.79 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 -3.24 2.73 0.26 -0.32 3.72 0.62 -4.90 117.46 116.33 1cdn n PHE 36 Ca -0.43 -3.62 0.09 0.00 -0.05 0.00 0.00 57.45 53.44 1cdn n PHE 36 Cb 1.01 -0.37 0.66 0.00 -0.94 0.00 0.00 39.48 39.84 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 2.89 0.00 -0.97 -1.08 0.13 -1.56 -1.97 132.00 129.45 1cdn h PRO 37 Ca 0.14 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.33 1cdn h PRO 37 Cb 0.78 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.84 1cdn h PRO 37 CO 0.72 0.07 0.63 1.03 -0.23 0.00 0.00 178.00 180.22 1cdn h SER 38 N 0.00 0.99 -0.45 1.44 0.87 -1.90 0.19 113.55 114.68 1cdn h SER 38 Ca -0.00 0.01 0.09 0.00 -1.23 0.00 0.00 61.79 60.66 1cdn h SER 38 Cb 0.13 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 1cdn h SER 38 CO 0.01 0.63 0.31 -0.07 -0.53 0.00 0.00 176.83 177.18 1cdn h LEU 39 N 1.12 0.18 0.00 2.23 3.38 -1.71 -0.52 115.31 119.99 1cdn h LEU 39 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 1cdn h LEU 39 Cb 0.20 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1cdn h LEU 39 CO -0.17 0.11 0.00 0.18 0.09 0.00 0.00 178.44 178.66 1cdn n LEU 40 N -4.45 0.00 -0.33 1.67 4.77 0.06 -0.15 117.00 118.57 1cdn n LEU 40 Ca 0.07 0.28 0.01 0.00 -0.03 0.00 0.00 56.01 56.34 1cdn n LEU 40 Cb 0.38 -0.28 0.15 0.00 -2.33 0.00 0.00 43.42 41.34 1cdn n LEU 40 CO 0.35 -0.12 1.21 0.11 -1.33 0.00 0.00 177.39 177.61 1cdn h LYS 41 N 0.00 0.99 0.00 3.23 1.57 -1.18 -3.44 116.57 117.75 1cdn h LYS 41 Ca 0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1cdn h LYS 41 Cb 0.16 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1cdn h LYS 41 CO 0.00 0.65 0.00 0.41 -0.57 0.00 0.00 179.45 179.94 1cdn n GLY 42 N -1.34 0.00 2.58 3.86 0.00 -0.91 -5.04 105.19 104.34 1cdn n GLY 42 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 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 0.00 3.54 7.00 -0.02 0.00 0.79 -4.88 105.19 111.62 1cdn n GLY 43 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 4.53 -3.11 -4.91 1.61 2.88 -1.26 -4.72 113.62 108.63 1cdn n SER 44 Ca 0.57 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.84 1cdn n SER 44 Cb 0.22 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.68 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 4.70 0.14 2.46 -4.23 -1.26 -4.93 115.64 112.52 1cdn s THR 45 Ca 0.00 0.19 -0.16 0.00 -1.18 0.00 0.00 61.69 60.54 1cdn s THR 45 Cb 0.00 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 70.04 1cdn s THR 45 CO 0.00 -0.80 1.73 -0.07 -0.54 0.00 0.00 174.62 174.94 1cdn h LEU 46 N 0.14 0.51 -0.11 4.79 3.38 -1.99 0.13 115.31 122.17 1cdn h LEU 46 Ca -0.47 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.40 1cdn h LEU 46 Cb 1.21 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1cdn h LEU 46 CO 0.61 0.47 0.07 0.44 0.09 0.00 0.00 178.44 180.13 1cdn h ASP 47 N 0.51 0.13 -0.48 -0.43 5.19 -1.97 0.24 116.42 119.62 1cdn h ASP 47 Ca 0.14 -0.02 -0.05 0.00 -0.62 0.00 0.00 57.03 56.48 1cdn h ASP 47 Cb 0.08 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.54 1cdn h ASP 47 CO -0.02 0.11 0.10 -0.08 -3.12 0.00 0.00 179.24 176.23 1cdn h GLU 48 N 0.14 0.77 -0.16 3.56 4.22 -1.91 0.22 114.58 121.42 1cdn h GLU 48 Ca 0.04 -0.19 0.03 0.00 0.08 0.00 0.00 59.36 59.32 1cdn h GLU 48 Cb -0.00 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.12 1cdn h GLU 48 CO -0.01 0.76 -0.02 1.25 -2.18 0.00 0.00 179.01 178.82 1cdn h LEU 49 N 0.65 -0.09 -0.62 1.64 5.85 -0.48 0.69 115.31 122.95 1cdn h LEU 49 Ca 0.15 0.04 0.11 0.00 0.84 0.00 0.00 57.88 59.02 1cdn h LEU 49 Cb 0.35 0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.37 1cdn h LEU 49 CO 0.00 -0.03 0.17 0.15 -0.34 0.00 0.00 178.44 178.40 1cdn h PHE 50 N 0.03 0.28 -0.22 1.25 3.04 -0.26 -0.16 116.94 120.91 1cdn h PHE 50 Ca 0.07 0.03 0.04 0.00 3.98 0.00 0.00 57.97 62.09 1cdn h PHE 50 Cb 0.10 -0.03 -0.03 0.00 2.56 0.00 0.00 35.95 38.54 1cdn h PHE 50 CO -0.17 0.01 0.00 1.49 -2.02 0.00 0.00 178.31 177.63 1cdn h GLU 51 N 0.31 0.07 -0.53 1.11 4.81 0.04 0.18 114.58 120.58 1cdn h GLU 51 Ca 0.33 -0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.65 1cdn h GLU 51 Cb 0.47 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.75 1cdn h GLU 51 CO -0.38 0.05 0.05 0.93 -0.73 0.00 0.00 179.01 178.93 1cdn h GLU 52 N 0.08 0.17 0.43 1.92 5.08 0.79 -1.11 114.58 121.93 1cdn h GLU 52 Ca 0.10 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1cdn h GLU 52 Cb 0.13 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1cdn h GLU 52 CO -0.17 0.11 -0.21 -0.07 -1.00 0.00 0.00 179.01 177.67 1cdn h LEU 53 N 0.17 -0.49 -6.65 1.33 3.38 -0.76 -3.38 115.31 108.91 1cdn h LEU 53 Ca 0.27 -0.09 -0.64 0.00 0.09 0.00 0.00 57.88 57.51 1cdn h LEU 53 Cb 0.40 0.13 -0.39 0.00 0.09 0.00 0.00 40.66 40.88 1cdn h LEU 53 CO -0.40 -0.19 -0.36 -0.67 0.09 0.00 0.00 178.44 176.91 1cdn n ASP 54 N -5.25 3.96 0.39 -0.43 2.03 0.60 -4.87 116.55 112.98 1cdn n ASP 54 Ca -0.11 -3.34 -0.18 0.00 0.52 0.00 0.00 54.79 51.68 1cdn n ASP 54 Cb 0.29 -0.81 -0.09 0.00 -0.72 0.00 0.00 41.12 39.79 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 4.86 -0.92 -0.06 -0.67 1.79 -1.40 -3.39 116.57 116.78 1cdn h LYS 55 Ca 0.18 0.06 -0.17 0.00 -2.18 0.00 0.00 60.65 58.54 1cdn h LYS 55 Cb 0.70 0.21 -0.29 0.00 -1.58 0.00 0.00 32.23 31.27 1cdn h LYS 55 CO 0.87 -0.60 -0.74 0.27 -1.08 0.00 0.00 179.45 178.16 1cdn n ASN 56 N -5.49 0.21 0.02 0.86 6.94 -1.26 -5.01 115.26 111.54 1cdn n ASN 56 Ca -0.14 -2.02 -0.01 0.00 -0.02 0.00 0.00 54.58 52.39 1cdn n ASN 56 Cb 0.39 -0.04 -0.00 0.00 -2.36 0.00 0.00 39.78 37.76 1cdn n ASN 56 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 1cdn h GLY 57 N 0.91 -0.06 0.00 4.83 0.00 -1.90 -3.45 103.07 103.39 1cdn h GLY 57 Ca -0.35 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1cdn h GLY 57 CO -0.04 -0.02 0.00 1.34 0.00 0.00 0.00 176.54 177.82 1cdn n ASP 58 N -2.20 0.00 0.00 0.19 -0.08 -1.26 -5.03 116.55 108.17 1cdn n ASP 58 Ca -0.01 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.27 1cdn n ASP 58 Cb 0.02 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.48 1cdn n ASP 58 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1cdn n GLY 59 N 0.00 0.57 3.38 0.27 0.00 -1.26 -5.06 105.19 103.08 1cdn n GLY 59 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.67 1.80 -0.42 1.61 2.02 -1.26 -4.97 118.70 116.81 1cdn s GLU 60 Ca 0.00 -1.88 -0.06 0.00 0.02 0.00 0.00 54.97 53.05 1cdn s GLU 60 Cb 0.00 0.38 0.10 0.00 0.10 0.00 0.00 34.13 34.71 1cdn s GLU 60 CO 0.00 -0.71 0.25 0.08 0.02 0.00 0.00 175.26 174.90 1cdn s VAL 61 N -3.29 3.81 0.86 2.63 1.01 -0.09 -4.81 120.40 120.53 1cdn s VAL 61 Ca 0.36 -1.74 -0.13 0.00 0.00 0.00 0.00 61.98 60.47 1cdn s VAL 61 Cb 0.01 -3.47 0.11 0.00 0.00 0.00 0.00 36.38 33.04 1cdn s VAL 61 CO 0.23 -0.62 1.17 -0.94 0.00 0.00 0.00 175.10 174.95 1cdn s SER 62 N 2.12 3.97 0.23 3.32 1.04 -1.26 -0.49 113.70 122.63 1cdn s SER 62 Ca 0.05 0.81 -0.08 0.00 0.48 0.00 0.00 55.95 57.20 1cdn s SER 62 Cb -0.24 -1.29 0.22 0.00 0.10 0.00 0.00 66.02 64.81 1cdn s SER 62 CO -0.01 -2.24 1.89 0.15 0.98 0.00 0.00 173.24 174.01 1cdn h PHE 63 N -1.29 1.06 0.70 5.02 3.57 -1.96 0.45 116.94 124.50 1cdn h PHE 63 Ca -0.48 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.02 1cdn h PHE 63 Cb 1.32 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 39.71 1cdn h PHE 63 CO 0.15 0.65 -0.38 1.05 -2.23 0.00 0.00 178.31 177.55 1cdn h GLU 64 N 1.13 -0.96 -0.44 1.11 -0.00 -1.93 -2.54 114.58 110.94 1cdn h GLU 64 Ca 0.32 0.07 -0.03 0.00 -0.00 0.00 0.00 59.36 59.72 1cdn h GLU 64 Cb -0.09 0.22 -0.02 0.00 -0.00 0.00 0.00 28.75 28.85 1cdn h GLU 64 CO -0.08 -0.64 0.15 1.05 -0.00 0.00 0.00 179.01 179.49 1cdn h GLU 65 N -1.00 0.63 -1.01 1.06 4.11 -1.86 -0.15 114.58 116.36 1cdn h GLU 65 Ca -0.09 -0.09 0.26 0.00 0.07 0.00 0.00 59.36 59.51 1cdn h GLU 65 Cb 0.79 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.85 1cdn h GLU 65 CO 0.12 0.55 0.68 0.35 0.07 0.00 0.00 179.01 180.78 1cdn h PHE 66 N 0.63 0.42 0.00 2.06 3.57 -0.71 0.11 116.94 123.02 1cdn h PHE 66 Ca 0.15 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 1cdn h PHE 66 Cb 0.17 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 38.78 1cdn h PHE 66 CO 0.01 0.06 -0.01 1.96 -2.23 0.00 0.00 178.31 178.10 1cdn h GLN 67 N 0.27 0.00 0.00 1.11 1.08 -0.59 0.35 115.11 117.33 1cdn h GLN 67 Ca 0.54 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.71 1cdn h GLN 67 Cb 1.59 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 29.02 1cdn h GLN 67 CO -0.18 0.01 -0.13 0.28 -0.95 0.00 0.00 178.83 177.86 1cdn h VAL 68 N 0.00 1.04 -0.08 -0.54 2.07 -0.90 0.15 116.25 117.99 1cdn h VAL 68 Ca -0.00 -0.46 -0.08 0.00 0.82 0.00 0.00 66.70 66.99 1cdn h VAL 68 Cb 0.02 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1cdn h VAL 68 CO 0.00 0.13 -0.25 0.25 0.02 0.00 0.00 177.57 177.72 1cdn h LEU 69 N 0.00 0.36 -1.07 2.57 6.46 -0.41 -0.26 115.31 122.95 1cdn h LEU 69 Ca -0.00 -0.61 0.06 0.00 -0.12 0.00 0.00 57.88 57.21 1cdn h LEU 69 Cb 0.24 -0.11 -0.06 0.00 -0.73 0.00 0.00 40.66 40.00 1cdn h LEU 69 CO 0.02 0.90 0.62 0.58 -0.62 0.00 0.00 178.44 179.94 1cdn h VAL 70 N -0.16 1.10 0.15 1.05 2.07 -0.98 0.85 116.25 120.33 1cdn h VAL 70 Ca -0.01 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.13 1cdn h VAL 70 Cb 0.87 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1cdn h VAL 70 CO 0.05 0.21 -0.13 0.50 0.02 0.00 0.00 177.57 178.22 1cdn h LYS 71 N 1.13 -0.29 -0.63 1.57 3.64 -0.52 0.12 116.57 121.59 1cdn h LYS 71 Ca 0.41 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.93 1cdn h LYS 71 Cb 0.14 0.07 -0.12 0.00 -0.41 0.00 0.00 32.23 31.91 1cdn h LYS 71 CO -0.15 -0.19 -0.18 0.87 -2.27 0.00 0.00 179.45 177.53 1cdn h LYS 72 N -0.30 -0.02 0.04 1.90 6.56 0.10 -0.98 116.57 123.87 1cdn h LYS 72 Ca -0.00 0.00 0.02 0.00 -1.06 0.00 0.00 60.65 59.61 1cdn h LYS 72 Cb 0.28 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 31.91 1cdn h LYS 72 CO -0.02 -0.01 -0.19 0.82 -2.06 0.00 0.00 179.45 177.98 1cdn h ILE 73 N -0.02 0.56 0.00 1.86 2.04 -0.58 -2.55 117.51 118.82 1cdn h ILE 73 Ca 0.30 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 66.04 1cdn h ILE 73 Cb 0.48 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1cdn h ILE 73 CO -0.66 0.00 -0.21 -1.20 0.00 0.00 0.00 178.15 176.08 1cdn n SER 74 N -5.32 4.67 0.00 1.72 7.64 0.39 -5.10 113.62 117.62 1cdn n SER 74 Ca -0.06 -2.33 0.00 0.00 1.01 0.00 0.00 58.87 57.49 1cdn n SER 74 Cb 0.23 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.25 1cdn n SER 74 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03