#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 4.95 0.40 4.39 1.04 -1.26 -4.80 113.70 118.42 1cdn s SER 2 Ca 0.00 1.65 0.17 0.00 0.48 0.00 0.00 55.95 58.25 1cdn s SER 2 Cb 0.00 -2.45 1.07 0.00 0.10 0.00 0.00 66.02 64.73 1cdn s SER 2 CO 0.00 -1.72 1.80 -0.65 0.98 0.00 0.00 173.24 173.65 1cdn h PRO 3 N -0.91 0.42 -0.03 4.02 0.11 -2.01 0.15 132.00 133.75 1cdn h PRO 3 Ca -0.44 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1cdn h PRO 3 Cb 1.22 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1cdn h PRO 3 CO 0.55 0.28 0.01 0.93 -0.21 0.00 0.00 178.00 179.56 1cdn h GLU 4 N 0.43 0.04 -0.47 1.05 5.08 -1.99 0.21 114.58 118.94 1cdn h GLU 4 Ca 0.55 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.93 1cdn h GLU 4 Cb 1.34 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.56 1cdn h GLU 4 CO -0.26 0.21 0.27 0.93 -1.00 0.00 0.00 179.01 179.16 1cdn h GLU 5 N -0.14 0.53 -0.76 2.33 4.39 -1.63 -1.22 114.58 118.07 1cdn h GLU 5 Ca 0.01 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 1cdn h GLU 5 Cb 0.19 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 28.68 1cdn h GLU 5 CO -0.00 0.35 0.45 -0.07 -1.16 0.00 0.00 179.01 178.58 1cdn h LEU 6 N 0.54 0.91 0.25 1.33 3.38 -0.52 0.19 115.31 121.40 1cdn h LEU 6 Ca 0.19 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1cdn h LEU 6 Cb 0.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1cdn h LEU 6 CO -0.09 0.71 -0.21 0.50 0.09 0.00 0.00 178.44 179.43 1cdn h LYS 7 N 1.05 -0.46 -0.40 1.13 1.63 -0.20 0.31 116.57 119.63 1cdn h LYS 7 Ca 0.27 0.03 0.08 0.00 -0.85 0.00 0.00 60.65 60.19 1cdn h LYS 7 Cb -0.04 0.10 -0.09 0.00 -0.60 0.00 0.00 32.23 31.61 1cdn h LYS 7 CO -0.05 -0.31 -0.26 0.78 -3.45 0.00 0.00 179.45 176.17 1cdn h GLY 8 N -0.47 -0.06 0.69 5.01 0.00 -0.11 0.10 103.07 108.23 1cdn h GLY 8 Ca -0.01 0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.67 1cdn h GLY 8 CO -0.02 -0.21 -0.10 -2.22 0.00 0.00 0.00 176.54 173.99 1cdn h ILE 9 N -0.19 0.73 -0.48 2.60 1.08 -0.61 0.91 117.51 121.55 1cdn h ILE 9 Ca 0.19 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.75 1cdn h ILE 9 Cb 0.49 0.73 -0.08 0.00 -3.07 0.00 0.00 36.82 34.88 1cdn h ILE 9 CO -0.51 0.00 -0.03 0.15 -0.69 0.00 0.00 178.15 177.07 1cdn h PHE 10 N -0.16 -0.08 -0.05 1.37 3.04 0.60 -1.82 116.94 119.84 1cdn h PHE 10 Ca 0.05 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 62.04 1cdn h PHE 10 Cb 0.23 0.11 -0.00 0.00 2.56 0.00 0.00 35.95 38.85 1cdn h PHE 10 CO -0.19 -0.13 0.02 0.93 -2.02 0.00 0.00 178.31 176.92 1cdn h GLU 11 N 0.08 0.07 -0.95 1.11 5.08 -0.42 0.19 114.58 119.74 1cdn h GLU 11 Ca 0.24 -0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.76 1cdn h GLU 11 Cb 0.36 -0.01 -0.17 0.00 0.50 0.00 0.00 28.75 29.43 1cdn h GLU 11 CO -0.42 0.24 -0.29 1.17 -1.00 0.00 0.00 179.01 178.71 1cdn n LYS 12 N -4.95 -0.13 -0.06 2.33 3.00 0.28 -0.39 118.16 118.23 1cdn n LYS 12 Ca -0.07 1.48 -0.04 0.00 -0.00 0.00 0.00 58.31 59.69 1cdn n LYS 12 Cb 0.12 -2.21 -0.03 0.00 0.00 0.00 0.00 35.03 32.91 1cdn n LYS 12 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.40 179.28 1cdn h TYR 13 N 0.00 0.00 -0.85 5.64 0.05 -1.15 -3.38 116.97 117.28 1cdn h TYR 13 Ca 0.41 0.00 0.20 0.00 0.05 0.00 0.00 58.73 59.39 1cdn h TYR 13 Cb 0.65 0.00 -0.12 0.00 1.01 0.00 0.00 36.73 38.27 1cdn h TYR 13 CO -0.77 0.25 0.33 0.00 -1.05 0.00 0.00 178.16 176.91 1cdn h ALA 14 N -0.79 1.27 -1.18 3.88 0.00 -0.42 -1.21 119.26 120.81 1cdn h ALA 14 Ca -0.01 0.16 0.34 0.00 0.00 0.00 0.00 54.91 55.39 1cdn h ALA 14 Cb 0.30 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.17 1cdn h ALA 14 CO -0.01 -0.32 0.80 0.00 0.00 0.00 0.00 179.25 179.72 1cdn h ALA 15 N 1.67 2.71 -0.00 0.00 0.00 -0.84 0.12 119.26 122.92 1cdn h ALA 15 Ca 0.51 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1cdn h ALA 15 Cb 0.92 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1cdn h ALA 15 CO -0.51 -1.13 0.00 0.87 0.00 0.00 0.00 179.25 178.47 1cdn h LYS 16 N 0.18 0.00 0.00 0.00 1.57 -1.42 0.17 116.57 117.08 1cdn h LYS 16 Ca 0.64 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.42 1cdn h LYS 16 Cb 2.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.37 1cdn h LYS 16 CO -0.20 0.00 0.00 0.93 -0.57 0.00 0.00 179.45 179.61 1cdn h GLU 17 N 0.00 0.00 0.00 3.15 5.08 -0.95 -3.48 114.58 118.39 1cdn h GLU 17 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1cdn h GLU 17 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1cdn h GLU 17 CO -0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 1cdn n GLY 18 N 1.23 2.60 3.65 -3.84 0.00 0.60 -5.00 105.19 104.43 1cdn n GLY 18 Ca 0.05 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 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 6.34 0.27 1.61 -1.08 -1.26 -4.73 116.67 117.82 1cdn s ASP 19 Ca 0.00 2.32 0.15 0.00 -0.52 0.00 0.00 52.55 54.49 1cdn s ASP 19 Cb 0.00 -2.53 0.07 0.00 -1.46 0.00 0.00 42.92 39.00 1cdn s ASP 19 CO 0.00 -1.19 1.44 1.55 0.52 0.00 0.00 175.17 177.49 1cdn h PRO 20 N 11.07 0.00 -0.01 4.34 0.13 -1.91 -3.34 132.00 142.28 1cdn h PRO 20 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 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 0.95 0.53 -0.29 0.09 -0.23 0.00 0.00 178.00 179.05 1cdn n ASN 21 N -3.24 1.10 -3.76 1.44 4.13 -1.26 -4.43 115.26 109.24 1cdn n ASN 21 Ca 0.02 -0.93 -0.15 0.00 1.68 0.00 0.00 54.58 55.20 1cdn n ASN 21 Cb 0.74 0.18 -0.15 0.00 -1.54 0.00 0.00 39.78 39.01 1cdn n ASN 21 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 1cdn s GLN 22 N -2.52 0.01 -0.13 3.52 0.74 -1.26 -1.01 119.66 119.01 1cdn s GLN 22 Ca 0.23 0.27 -0.06 0.00 0.05 0.00 0.00 55.36 55.85 1cdn s GLN 22 Cb 0.19 -0.23 -0.04 0.00 1.10 0.00 0.00 33.01 34.03 1cdn s GLN 22 CO 0.53 -0.17 0.09 -0.51 -0.55 0.00 0.00 175.29 174.68 1cdn s LEU 23 N 1.16 4.07 0.88 3.68 1.43 0.36 -4.73 118.68 125.53 1cdn s LEU 23 Ca -0.09 0.30 -0.14 0.00 -1.03 0.00 0.00 54.13 53.18 1cdn s LEU 23 Cb -0.12 -1.99 0.13 0.00 0.03 0.00 0.00 46.19 44.24 1cdn s LEU 23 CO -0.04 0.34 1.23 -0.94 0.23 0.00 0.00 176.35 177.17 1cdn s SER 24 N -0.63 3.89 0.16 2.29 1.04 -1.26 -0.67 113.70 118.51 1cdn s SER 24 Ca 0.12 0.61 -0.16 0.00 0.48 0.00 0.00 55.95 57.00 1cdn s SER 24 Cb -0.12 -0.94 0.07 0.00 0.10 0.00 0.00 66.02 65.13 1cdn s SER 24 CO 0.02 -2.28 1.75 0.11 0.98 0.00 0.00 173.24 173.82 1cdn h LYS 25 N -1.32 0.27 -0.27 4.02 1.57 -1.98 -0.11 116.57 118.75 1cdn h LYS 25 Ca -0.46 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.28 1cdn h LYS 25 Cb 1.30 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 1cdn h LYS 25 CO 0.55 0.18 0.08 1.49 -0.57 0.00 0.00 179.45 181.18 1cdn h GLU 26 N 0.28 0.42 -0.75 3.15 4.81 -1.98 0.23 114.58 120.73 1cdn h GLU 26 Ca 0.17 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1cdn h GLU 26 Cb 0.15 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 1cdn h GLU 26 CO -0.18 0.50 0.41 0.93 -0.73 0.00 0.00 179.01 179.94 1cdn h GLU 27 N 0.27 1.05 -0.59 1.92 3.07 -1.89 1.00 114.58 119.41 1cdn h GLU 27 Ca 0.09 -0.12 0.05 0.00 -0.50 0.00 0.00 59.36 58.87 1cdn h GLU 27 Cb 0.25 -0.21 -0.05 0.00 -0.84 0.00 0.00 28.75 27.91 1cdn h GLU 27 CO -0.00 0.78 0.31 -0.07 -1.40 0.00 0.00 179.01 178.64 1cdn h LEU 28 N 1.04 0.46 -0.22 1.33 3.38 -0.63 0.10 115.31 120.78 1cdn h LEU 28 Ca 0.27 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 1cdn h LEU 28 Cb 0.04 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1cdn h LEU 28 CO -0.04 0.31 0.12 0.50 0.09 0.00 0.00 178.44 179.41 1cdn h LYS 29 N 0.60 0.31 -0.17 1.13 3.64 0.68 0.23 116.57 122.99 1cdn h LYS 29 Ca 0.26 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1cdn h LYS 29 Cb 0.16 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1cdn h LYS 29 CO -0.17 0.29 0.11 -0.07 -2.27 0.00 0.00 179.45 177.34 1cdn h LEU 30 N 0.25 0.20 -0.04 5.20 4.07 -0.72 0.18 115.31 124.45 1cdn h LEU 30 Ca 0.08 -0.03 0.03 0.00 0.08 0.00 0.00 57.88 58.04 1cdn h LEU 30 Cb 0.07 -0.05 -0.06 0.00 1.08 0.00 0.00 40.66 41.70 1cdn h LEU 30 CO -0.01 0.17 -0.47 0.25 -1.08 0.00 0.00 178.44 177.31 1cdn h LEU 31 N 0.22 -1.44 0.18 1.67 6.46 -0.47 0.37 115.31 122.30 1cdn h LEU 31 Ca 0.06 0.17 0.01 0.00 -0.12 0.00 0.00 57.88 58.00 1cdn h LEU 31 Cb 0.00 0.56 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 1cdn h LEU 31 CO -0.01 -0.47 -0.20 -0.07 -0.62 0.00 0.00 178.44 177.07 1cdn h LEU 32 N -0.59 -0.52 -0.32 2.25 3.38 -0.38 0.37 115.31 119.50 1cdn h LEU 32 Ca 0.04 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.12 1cdn h LEU 32 Cb 0.67 0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 1cdn h LEU 32 CO -0.36 -0.29 -0.02 -0.61 0.09 0.00 0.00 178.44 177.25 1cdn h GLN 33 N -0.41 0.07 0.01 1.13 4.15 -0.39 0.35 115.11 120.02 1cdn h GLN 33 Ca 0.00 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 1cdn h GLN 33 Cb 0.40 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.07 1cdn h GLN 33 CO -0.06 0.04 -0.01 1.15 -1.93 0.00 0.00 178.83 178.03 1cdn h THR 34 N 0.07 1.45 0.00 2.39 2.02 -0.74 -3.30 112.91 114.80 1cdn h THR 34 Ca 0.16 -1.47 -0.31 0.00 0.77 0.00 0.00 66.41 65.55 1cdn h THR 34 Cb 0.22 2.43 -0.06 0.00 -1.74 0.00 0.00 68.15 69.01 1cdn h THR 34 CO -0.28 0.37 -1.88 -0.62 0.37 0.00 0.00 175.52 173.49 1cdn n GLU 35 N -4.80 0.65 -3.14 6.66 -0.58 0.10 -4.62 120.64 114.91 1cdn n GLU 35 Ca -0.09 0.22 -0.18 0.00 -0.42 0.00 0.00 57.16 56.70 1cdn n GLU 35 Cb 0.31 -1.73 -0.02 0.00 -0.57 0.00 0.00 31.44 29.44 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 -2.97 -0.23 0.22 -0.32 3.72 0.12 -4.96 117.46 113.04 1cdn n PHE 36 Ca -0.21 -3.60 0.07 0.00 -0.05 0.00 0.00 57.45 53.67 1cdn n PHE 36 Cb 1.08 -0.19 0.59 0.00 -0.94 0.00 0.00 39.48 40.03 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 3.15 0.06 0.18 -1.08 0.13 -1.51 0.43 132.00 133.36 1cdn h PRO 37 Ca 0.07 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 65.21 1cdn h PRO 37 Cb 0.97 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.05 1cdn h PRO 37 CO 0.46 0.07 -0.40 0.66 -0.23 0.00 0.00 178.00 178.56 1cdn h SER 38 N 0.07 -1.15 -0.43 1.44 4.64 -1.91 -0.95 113.55 115.25 1cdn h SER 38 Ca 0.02 0.12 -0.10 0.00 -0.47 0.00 0.00 61.79 61.36 1cdn h SER 38 Cb 0.04 0.42 -0.02 0.00 -0.31 0.00 0.00 62.40 62.54 1cdn h SER 38 CO -0.00 -0.49 -0.11 -0.07 -0.87 0.00 0.00 176.83 175.29 1cdn h LEU 39 N -0.67 0.89 -0.37 5.97 3.38 -1.57 0.24 115.31 123.18 1cdn h LEU 39 Ca 0.01 -0.28 0.07 0.00 0.09 0.00 0.00 57.88 57.77 1cdn h LEU 39 Cb 0.68 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 41.12 1cdn h LEU 39 CO -0.20 1.01 -0.06 0.25 0.09 0.00 0.00 178.44 179.54 1cdn h LEU 40 N 0.80 -0.27 0.21 1.67 7.12 -0.63 -2.46 115.31 121.75 1cdn h LEU 40 Ca 0.13 0.10 -0.01 0.00 0.13 0.00 0.00 57.88 58.23 1cdn h LEU 40 Cb 0.63 0.20 0.00 0.00 -0.53 0.00 0.00 40.66 40.97 1cdn h LEU 40 CO 0.04 -0.09 -0.10 0.11 -0.13 0.00 0.00 178.44 178.27 1cdn h LYS 41 N 0.04 -0.28 -3.83 1.25 1.57 -1.07 -3.37 116.57 110.88 1cdn h LYS 41 Ca 0.18 0.02 -0.69 0.00 -1.87 0.00 0.00 60.65 58.29 1cdn h LYS 41 Cb 0.27 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1cdn h LYS 41 CO -0.35 -0.18 3.21 0.41 -0.57 0.00 0.00 179.45 181.96 1cdn n GLY 42 N 0.33 4.23 3.67 3.86 0.00 0.84 -4.83 105.19 113.29 1cdn n GLY 42 Ca -0.04 -1.53 -0.10 0.00 0.00 0.00 0.00 46.02 44.35 1cdn n GLY 42 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cdn s GLY 43 N 3.13 0.66 0.87 -0.02 0.00 -0.93 -4.53 107.32 106.50 1cdn s GLY 43 Ca 0.52 -0.94 -0.10 0.00 0.00 0.00 0.00 44.72 44.20 1cdn s GLY 43 CO -0.07 -0.55 1.13 -1.35 0.00 0.00 0.00 173.10 172.26 1cdn s SER 44 N -3.08 3.44 0.49 1.64 1.04 -1.26 -4.98 113.70 110.99 1cdn s SER 44 Ca 0.21 2.06 -0.24 0.00 0.48 0.00 0.00 55.95 58.46 1cdn s SER 44 Cb -0.03 -2.55 -0.07 0.00 0.10 0.00 0.00 66.02 63.47 1cdn s SER 44 CO 0.13 -2.75 1.39 0.35 0.98 0.00 0.00 173.24 173.33 1cdn n THR 45 N -4.00 3.19 -0.24 2.02 -2.24 -1.26 -4.65 114.28 107.10 1cdn n THR 45 Ca 0.11 -0.50 0.04 0.00 -2.27 0.00 0.00 64.05 61.43 1cdn n THR 45 Cb 0.52 -1.74 0.16 0.00 -2.10 0.00 0.00 70.33 67.17 1cdn n THR 45 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1cdn h LEU 46 N 1.92 0.06 0.19 3.22 5.85 -1.95 0.16 115.31 124.76 1cdn h LEU 46 Ca -0.51 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.34 1cdn h LEU 46 Cb 1.29 0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.48 1cdn h LEU 46 CO 0.59 -0.00 -0.09 0.44 -0.34 0.00 0.00 178.44 179.04 1cdn h ASP 47 N 0.30 -0.22 -0.34 1.25 3.32 -1.99 0.16 116.42 118.89 1cdn h ASP 47 Ca 0.39 0.01 0.05 0.00 0.02 0.00 0.00 57.03 57.49 1cdn h ASP 47 Cb 0.63 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 40.20 1cdn h ASP 47 CO -0.47 -0.16 0.07 -0.08 -1.72 0.00 0.00 179.24 176.89 1cdn h GLU 48 N -0.26 0.19 -0.12 3.56 4.81 -1.56 -0.19 114.58 121.00 1cdn h GLU 48 Ca -0.03 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1cdn h GLU 48 Cb 0.20 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 1cdn h GLU 48 CO 0.04 0.12 -0.09 1.25 -0.73 0.00 0.00 179.01 179.60 1cdn h LEU 49 N 0.19 -0.30 -0.23 1.64 5.85 -0.45 0.92 115.31 122.93 1cdn h LEU 49 Ca 0.16 0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.99 1cdn h LEU 49 Cb 0.17 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 1cdn h LEU 49 CO -0.21 -0.13 -0.09 0.15 -0.34 0.00 0.00 178.44 177.83 1cdn h PHE 50 N -0.10 -0.20 -0.31 1.25 3.57 -0.18 0.16 116.94 121.13 1cdn h PHE 50 Ca 0.08 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.61 1cdn h PHE 50 Cb 0.22 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 1cdn h PHE 50 CO -0.22 -0.14 0.18 0.93 -2.23 0.00 0.00 178.31 176.83 1cdn h GLU 51 N -0.04 0.35 -0.60 1.11 5.08 -0.63 0.91 114.58 120.76 1cdn h GLU 51 Ca 0.12 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1cdn h GLU 51 Cb 0.22 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1cdn h GLU 51 CO -0.26 0.23 0.26 0.93 -1.00 0.00 0.00 179.01 179.17 1cdn h GLU 52 N 0.36 0.87 -0.09 2.33 4.39 -0.25 -2.95 114.58 119.23 1cdn h GLU 52 Ca 0.12 -0.13 -0.11 0.00 0.34 0.00 0.00 59.36 59.58 1cdn h GLU 52 Cb 0.00 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.50 1cdn h GLU 52 CO -0.06 0.70 -0.37 -0.07 -1.16 0.00 0.00 179.01 178.05 1cdn h LEU 53 N 0.86 0.49 -5.08 1.33 3.38 -0.28 -3.38 115.31 112.63 1cdn h LEU 53 Ca 0.21 -0.63 -0.63 0.00 0.09 0.00 0.00 57.88 56.92 1cdn h LEU 53 Cb 0.14 -0.14 0.03 0.00 0.09 0.00 0.00 40.66 40.78 1cdn h LEU 53 CO -0.02 1.03 3.68 -0.67 0.09 0.00 0.00 178.44 182.56 1cdn n ASP 54 N -4.36 8.18 -4.37 -0.43 2.03 0.28 -4.66 116.55 113.21 1cdn n ASP 54 Ca -0.08 -2.54 -0.37 0.00 0.52 0.00 0.00 54.79 52.32 1cdn n ASP 54 Cb 0.52 -1.50 -0.03 0.00 -0.72 0.00 0.00 41.12 39.40 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 3.71 2.35 0.00 -0.67 4.76 -1.26 -1.70 118.16 125.35 1cdn n LYS 55 Ca 0.74 -2.73 0.00 0.00 -2.87 0.00 0.00 58.31 53.45 1cdn n LYS 55 Cb 0.22 -3.50 0.00 0.00 -1.84 0.00 0.00 35.03 29.91 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 10.33 0.00 0.00 4.39 0.23 -1.26 -5.05 115.26 123.90 1cdn n ASN 56 Ca 0.48 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.53 1cdn n ASN 56 Cb 0.45 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.15 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 -0.72 0.85 0.18 4.83 0.00 -0.69 -4.97 105.19 104.67 1cdn n GLY 57 Ca 0.00 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 0.60 0.00 1.61 2.03 -1.98 -3.48 116.42 115.19 1cdn h ASP 58 Ca 0.00 -0.42 0.00 0.00 -0.73 0.00 0.00 57.03 55.88 1cdn h ASP 58 Cb 0.00 -0.18 0.00 0.00 -0.83 0.00 0.00 39.33 38.32 1cdn h ASP 58 CO 0.00 1.19 0.00 0.61 -1.03 0.00 0.00 179.24 180.01 1cdn n GLY 59 N 0.73 2.46 3.72 7.15 0.00 -1.26 -5.09 105.19 112.90 1cdn n GLY 59 Ca -0.06 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 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 4.53 -0.29 1.61 2.02 -1.26 -4.73 118.70 120.58 1cdn s GLU 60 Ca 0.00 1.56 -0.29 0.00 0.02 0.00 0.00 54.97 56.27 1cdn s GLU 60 Cb 0.00 -3.40 0.01 0.00 0.10 0.00 0.00 34.13 30.85 1cdn s GLU 60 CO 0.00 -0.08 1.05 0.08 0.02 0.00 0.00 175.26 176.32 1cdn s VAL 61 N 0.82 4.58 0.61 2.63 1.01 0.15 -4.73 120.40 125.48 1cdn s VAL 61 Ca 0.53 1.80 -0.14 0.00 0.00 0.00 0.00 61.98 64.18 1cdn s VAL 61 Cb -0.25 -4.36 -0.03 0.00 0.00 0.00 0.00 36.38 31.74 1cdn s VAL 61 CO 0.29 -0.36 1.04 -0.94 0.00 0.00 0.00 175.10 175.13 1cdn s SER 62 N 1.50 5.94 0.48 3.32 1.04 -1.26 -0.49 113.70 124.22 1cdn s SER 62 Ca 0.44 1.64 0.19 0.00 0.48 0.00 0.00 55.95 58.70 1cdn s SER 62 Cb -0.13 -2.51 1.20 0.00 0.10 0.00 0.00 66.02 64.68 1cdn s SER 62 CO 0.12 -1.06 1.98 0.15 0.98 0.00 0.00 173.24 175.40 1cdn h PHE 63 N 0.10 0.25 0.64 5.02 3.57 -1.45 0.11 116.94 125.17 1cdn h PHE 63 Ca -0.45 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.02 1cdn h PHE 63 Cb 1.20 -0.08 0.01 0.00 2.79 0.00 0.00 35.95 39.87 1cdn h PHE 63 CO 0.62 0.11 -0.31 0.93 -2.23 0.00 0.00 178.31 177.43 1cdn h GLU 64 N 0.22 -0.83 0.00 1.11 5.08 -1.92 -3.00 114.58 115.23 1cdn h GLU 64 Ca 0.28 0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.65 1cdn h GLU 64 Cb 0.81 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 1cdn h GLU 64 CO -0.05 -0.55 -0.23 1.05 -1.00 0.00 0.00 179.01 178.22 1cdn h GLU 65 N -1.07 0.00 -0.41 2.33 4.11 -1.82 0.33 114.58 118.05 1cdn h GLU 65 Ca -0.09 0.00 0.12 0.00 0.07 0.00 0.00 59.36 59.46 1cdn h GLU 65 Cb 0.66 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 1cdn h GLU 65 CO 0.14 0.23 0.48 0.35 0.07 0.00 0.00 179.01 180.29 1cdn h PHE 66 N 0.00 0.00 -0.19 2.06 3.57 -0.79 0.87 116.94 122.46 1cdn h PHE 66 Ca -0.00 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.55 1cdn h PHE 66 Cb 0.49 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1cdn h PHE 66 CO 0.00 0.00 0.28 1.96 -2.23 0.00 0.00 178.31 178.32 1cdn h GLN 67 N 0.00 0.00 -0.60 1.11 1.08 -0.78 0.48 115.11 116.40 1cdn h GLN 67 Ca 0.19 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.39 1cdn h GLN 67 Cb 1.15 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.55 1cdn h GLN 67 CO -0.00 0.00 0.35 0.28 -0.95 0.00 0.00 178.83 178.51 1cdn h VAL 68 N 0.00 1.18 -0.09 -0.54 2.07 -1.01 0.21 116.25 118.07 1cdn h VAL 68 Ca 0.09 -0.41 -0.08 0.00 0.82 0.00 0.00 66.70 67.12 1cdn h VAL 68 Cb 0.66 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1cdn h VAL 68 CO -0.00 0.19 -0.26 0.25 0.02 0.00 0.00 177.57 177.76 1cdn h LEU 69 N 0.83 0.38 -0.84 2.57 6.46 -0.24 -1.25 115.31 123.24 1cdn h LEU 69 Ca 0.22 -0.60 0.11 0.00 -0.12 0.00 0.00 57.88 57.49 1cdn h LEU 69 Cb -0.01 -0.11 -0.08 0.00 -0.73 0.00 0.00 40.66 39.73 1cdn h LEU 69 CO -0.04 0.92 0.46 0.58 -0.62 0.00 0.00 178.44 179.74 1cdn h VAL 70 N -0.13 0.85 0.08 1.05 2.07 -0.95 0.14 116.25 119.36 1cdn h VAL 70 Ca -0.01 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.28 1cdn h VAL 70 Cb 0.88 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1cdn h VAL 70 CO 0.06 0.13 -0.21 0.50 0.02 0.00 0.00 177.57 178.07 1cdn h LYS 71 N 0.74 -0.37 -0.53 1.57 3.64 -0.40 0.69 116.57 121.92 1cdn h LYS 71 Ca 0.42 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.93 1cdn h LYS 71 Cb 0.46 0.08 -0.08 0.00 -0.41 0.00 0.00 32.23 32.29 1cdn h LYS 71 CO -0.29 -0.25 0.05 0.87 -2.27 0.00 0.00 179.45 177.57 1cdn h LYS 72 N -0.38 0.17 -0.41 1.90 6.56 0.12 0.26 116.57 124.78 1cdn h LYS 72 Ca 0.04 -0.01 0.08 0.00 -1.06 0.00 0.00 60.65 59.69 1cdn h LYS 72 Cb 0.42 -0.04 -0.07 0.00 -0.57 0.00 0.00 32.23 31.98 1cdn h LYS 72 CO -0.15 0.11 -0.02 0.82 -2.06 0.00 0.00 179.45 178.16 1cdn h ILE 73 N 0.18 0.67 -0.09 1.86 2.04 -0.43 -0.04 117.51 121.70 1cdn h ILE 73 Ca 0.27 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 66.10 1cdn h ILE 73 Cb 0.40 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1cdn h ILE 73 CO -0.40 0.02 0.00 -1.20 0.00 0.00 0.00 178.15 176.57 1cdn n SER 74 N -5.22 1.63 0.00 1.72 7.64 0.20 -5.10 113.62 114.50 1cdn n SER 74 Ca 0.03 -2.13 0.00 0.00 1.01 0.00 0.00 58.87 57.78 1cdn n SER 74 Cb 0.22 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 1cdn n SER 74 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03