#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 5.18 0.31 4.39 1.04 -1.26 -4.71 113.70 118.65 1cdn s SER 2 Ca 0.00 1.85 0.07 0.00 0.48 0.00 0.00 55.95 58.35 1cdn s SER 2 Cb 0.00 -2.53 0.88 0.00 0.10 0.00 0.00 66.02 64.47 1cdn s SER 2 CO 0.00 -1.58 1.65 -0.65 0.98 0.00 0.00 173.24 173.64 1cdn h PRO 3 N -0.26 0.23 -0.19 4.02 0.11 -2.02 0.19 132.00 134.08 1cdn h PRO 3 Ca -0.45 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.66 1cdn h PRO 3 Cb 1.23 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1cdn h PRO 3 CO 0.55 0.15 0.05 0.93 -0.21 0.00 0.00 178.00 179.47 1cdn h GLU 4 N 0.24 0.13 -0.51 1.05 3.07 -1.99 0.21 114.58 116.77 1cdn h GLU 4 Ca 0.64 -0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 59.39 1cdn h GLU 4 Cb 1.37 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 29.23 1cdn h GLU 4 CO -0.65 0.09 -0.06 0.93 -1.40 0.00 0.00 179.01 177.91 1cdn h GLU 5 N 0.13 0.92 -0.48 2.33 4.39 -1.23 -1.29 114.58 119.35 1cdn h GLU 5 Ca 0.08 -0.30 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 1cdn h GLU 5 Cb 0.07 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 1cdn h GLU 5 CO -0.10 0.95 0.18 -0.07 -1.16 0.00 0.00 179.01 178.81 1cdn h LEU 6 N 0.83 0.63 -0.08 1.33 3.38 -0.29 0.19 115.31 121.31 1cdn h LEU 6 Ca 0.14 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1cdn h LEU 6 Cb 0.58 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1cdn h LEU 6 CO 0.04 0.58 0.05 0.50 0.09 0.00 0.00 178.44 179.69 1cdn h LYS 7 N 0.69 0.11 -0.44 1.13 1.63 -0.12 0.23 116.57 119.80 1cdn h LYS 7 Ca 0.17 -0.01 0.09 0.00 -0.85 0.00 0.00 60.65 60.05 1cdn h LYS 7 Cb 0.15 -0.02 -0.09 0.00 -0.60 0.00 0.00 32.23 31.67 1cdn h LYS 7 CO -0.01 0.12 -0.19 0.78 -3.45 0.00 0.00 179.45 176.70 1cdn h GLY 8 N 0.06 0.14 0.82 5.01 0.00 -0.17 0.10 103.07 109.03 1cdn h GLY 8 Ca 0.03 0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.60 1cdn h GLY 8 CO -0.00 -0.20 -0.22 -2.22 0.00 0.00 0.00 176.54 173.89 1cdn h ILE 9 N -0.10 0.52 -0.52 2.60 1.08 -0.56 0.96 117.51 121.50 1cdn h ILE 9 Ca 0.21 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.78 1cdn h ILE 9 Cb 0.43 0.52 -0.10 0.00 -3.07 0.00 0.00 36.82 34.60 1cdn h ILE 9 CO -0.51 0.00 -0.24 0.15 -0.69 0.00 0.00 178.15 176.86 1cdn h PHE 10 N -0.52 -0.62 0.13 1.37 3.04 0.16 -0.36 116.94 120.15 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 0.46 0.35 0.00 0.00 2.56 0.00 0.00 35.95 39.32 1cdn h PHE 10 CO -0.12 -0.32 -0.06 0.93 -2.02 0.00 0.00 178.31 176.71 1cdn h GLU 11 N -0.12 -0.17 -0.66 1.11 5.08 -0.55 0.19 114.58 119.45 1cdn h GLU 11 Ca 0.24 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.73 1cdn h GLU 11 Cb 0.49 0.04 -0.12 0.00 0.50 0.00 0.00 28.75 29.66 1cdn h GLU 11 CO -0.59 -0.06 -0.31 -0.22 -1.00 0.00 0.00 179.01 176.83 1cdn h LYS 12 N -0.24 -0.11 0.11 2.33 3.64 0.20 0.17 116.57 122.66 1cdn h LYS 12 Ca -0.02 0.01 -0.20 0.00 -1.27 0.00 0.00 60.65 59.17 1cdn h LYS 12 Cb 0.19 0.02 0.02 0.00 -0.41 0.00 0.00 32.23 32.06 1cdn h LYS 12 CO 0.03 -0.07 -0.83 1.88 -2.27 0.00 0.00 179.45 178.18 1cdn h TYR 13 N -0.11 0.63 -0.13 1.91 0.05 -0.96 -3.28 116.97 115.08 1cdn h TYR 13 Ca 0.27 -0.42 0.04 0.00 0.05 0.00 0.00 58.73 58.66 1cdn h TYR 13 Cb 0.55 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 1cdn h TYR 13 CO -0.65 1.29 0.10 0.00 -1.05 0.00 0.00 178.16 177.85 1cdn h ALA 14 N 0.17 2.00 -0.37 3.88 0.00 -0.30 -0.15 119.26 124.48 1cdn h ALA 14 Ca -0.13 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.81 1cdn h ALA 14 Cb 1.61 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 1cdn h ALA 14 CO 0.16 -0.17 0.25 0.00 0.00 0.00 0.00 179.25 179.49 1cdn h ALA 15 N 1.92 1.92 -2.80 0.00 0.00 -0.74 -1.86 119.26 117.70 1cdn h ALA 15 Ca 0.06 -0.02 -0.53 0.00 0.00 0.00 0.00 54.91 54.42 1cdn h ALA 15 Cb 0.26 -0.09 0.13 0.00 0.00 0.00 0.00 17.79 18.09 1cdn h ALA 15 CO -0.00 0.02 0.45 0.15 0.00 0.00 0.00 179.25 179.87 1cdn s LYS 16 N -5.33 2.69 0.00 0.00 3.01 -0.07 -2.81 119.74 117.23 1cdn s LYS 16 Ca -0.07 1.80 0.00 0.00 -1.01 0.00 0.00 55.97 56.69 1cdn s LYS 16 Cb 0.18 -1.89 0.00 0.00 -1.01 0.00 0.00 37.83 35.11 1cdn s LYS 16 CO 0.72 -1.42 0.00 0.39 0.51 0.00 0.00 175.35 175.55 1cdn n GLU 17 N -1.99 0.00 0.00 1.68 1.02 -1.26 -3.76 120.64 116.33 1cdn n GLU 17 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1cdn n GLU 17 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.92 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 0.00 0.03 2.31 0.62 0.00 -1.12 -5.11 105.19 101.91 1cdn n GLY 18 Ca 0.00 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 1cdn n GLY 18 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1cdn n ASP 19 N 0.00 1.35 0.14 1.61 -0.08 -0.73 -4.97 116.55 113.87 1cdn n ASP 19 Ca 0.00 -3.03 0.18 0.00 -1.51 0.00 0.00 54.79 50.44 1cdn n ASP 19 Cb 0.00 -0.62 0.67 0.00 2.34 0.00 0.00 41.12 43.51 1cdn n ASP 19 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1cdn h PRO 20 N 3.47 0.00 0.00 -0.67 0.13 -1.77 -0.36 132.00 132.79 1cdn h PRO 20 Ca 0.10 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.12 1cdn h PRO 20 Cb 0.85 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.96 1cdn h PRO 20 CO 0.56 0.00 -0.60 -0.91 -0.23 0.00 0.00 178.00 176.82 1cdn h ASN 21 N 0.00 0.00 -2.56 1.44 2.35 -1.93 -3.42 115.58 111.46 1cdn h ASN 21 Ca 0.16 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.84 1cdn h ASN 21 Cb 1.27 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 39.38 1cdn h ASN 21 CO -0.00 0.53 -0.32 -1.58 -1.65 0.00 0.00 177.43 174.41 1cdn s GLN 22 N -2.95 0.38 0.07 0.81 0.74 -0.15 -4.04 119.66 114.51 1cdn s GLN 22 Ca 0.03 1.06 -0.30 0.00 0.05 0.00 0.00 55.36 56.21 1cdn s GLN 22 Cb 0.08 0.35 -0.05 0.00 1.10 0.00 0.00 33.01 34.49 1cdn s GLN 22 CO 0.75 -0.23 1.06 -0.51 -0.55 0.00 0.00 175.29 175.81 1cdn s LEU 23 N 2.46 4.41 0.84 3.68 1.43 0.67 -4.72 118.68 127.46 1cdn s LEU 23 Ca -0.04 1.85 -0.12 0.00 -1.03 0.00 0.00 54.13 54.80 1cdn s LEU 23 Cb -0.11 -3.58 0.10 0.00 0.03 0.00 0.00 46.19 42.62 1cdn s LEU 23 CO -0.14 -0.28 1.12 -0.94 0.23 0.00 0.00 176.35 176.34 1cdn s SER 24 N 0.65 4.11 0.32 2.29 1.04 -1.26 -0.38 113.70 120.47 1cdn s SER 24 Ca 0.52 1.15 0.02 0.00 0.48 0.00 0.00 55.95 58.12 1cdn s SER 24 Cb -0.25 -1.81 0.57 0.00 0.10 0.00 0.00 66.02 64.63 1cdn s SER 24 CO 0.30 -2.19 1.94 0.50 0.98 0.00 0.00 173.24 174.76 1cdn h LYS 25 N -1.25 0.94 -0.15 4.02 3.64 -1.96 0.75 116.57 122.56 1cdn h LYS 25 Ca -0.48 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 58.80 1cdn h LYS 25 Cb 1.30 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1cdn h LYS 25 CO 0.61 0.62 -0.04 0.93 -2.27 0.00 0.00 179.45 179.29 1cdn h GLU 26 N 0.97 0.29 -0.59 1.90 5.08 -1.99 0.36 114.58 120.60 1cdn h GLU 26 Ca 0.35 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.64 1cdn h GLU 26 Cb 0.14 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 1cdn h GLU 26 CO -0.12 0.58 0.33 0.93 -1.00 0.00 0.00 179.01 179.74 1cdn h GLU 27 N -0.02 0.62 -0.43 2.33 5.08 -1.79 0.97 114.58 121.34 1cdn h GLU 27 Ca 0.04 -0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1cdn h GLU 27 Cb 0.48 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.53 1cdn h GLU 27 CO 0.02 0.41 0.05 -0.07 -1.00 0.00 0.00 179.01 178.41 1cdn h LEU 28 N 0.64 -0.07 -0.67 1.33 3.38 -0.73 0.89 115.31 120.08 1cdn h LEU 28 Ca 0.26 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.31 1cdn h LEU 28 Cb 0.12 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1cdn h LEU 28 CO -0.15 -0.00 0.41 0.50 0.09 0.00 0.00 178.44 179.29 1cdn h LYS 29 N 0.17 0.90 0.20 1.13 3.64 0.76 0.28 116.57 123.64 1cdn h LYS 29 Ca 0.21 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 1cdn h LYS 29 Cb 0.28 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1cdn h LYS 29 CO -0.31 0.63 -0.09 -0.07 -2.27 0.00 0.00 179.45 177.34 1cdn h LEU 30 N 0.91 -0.22 -0.25 5.20 3.38 -0.60 0.56 115.31 124.28 1cdn h LEU 30 Ca 0.24 -0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.23 1cdn h LEU 30 Cb -0.05 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 40.68 1cdn h LEU 30 CO -0.05 -0.12 -0.48 0.25 0.09 0.00 0.00 178.44 178.14 1cdn h LEU 31 N -0.31 -1.54 0.36 1.67 6.46 -0.40 -0.07 115.31 121.48 1cdn h LEU 31 Ca -0.03 0.21 -0.01 0.00 -0.12 0.00 0.00 57.88 57.93 1cdn h LEU 31 Cb 0.24 0.63 -0.00 0.00 -0.73 0.00 0.00 40.66 40.80 1cdn h LEU 31 CO 0.04 -0.42 -0.21 -0.07 -0.62 0.00 0.00 178.44 177.16 1cdn h LEU 32 N -0.46 -0.52 -0.26 2.25 3.38 -0.39 0.11 115.31 119.42 1cdn h LEU 32 Ca 0.08 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.12 1cdn h LEU 32 Cb 0.63 0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 1cdn h LEU 32 CO -0.49 -0.34 0.03 1.56 0.09 0.00 0.00 178.44 179.29 1cdn h GLN 33 N -0.55 0.12 -0.06 1.13 4.20 -0.66 0.30 115.11 119.59 1cdn h GLN 33 Ca -0.04 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.61 1cdn h GLN 33 Cb 0.44 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1cdn h GLN 33 CO 0.05 0.08 -0.17 1.15 -0.67 0.00 0.00 178.83 179.27 1cdn h THR 34 N 0.12 1.44 0.04 -0.54 2.02 -0.84 -3.28 112.91 111.86 1cdn h THR 34 Ca 0.12 -1.55 -0.33 0.00 0.77 0.00 0.00 66.41 65.43 1cdn h THR 34 Cb 0.14 2.31 -0.04 0.00 -1.74 0.00 0.00 68.15 68.82 1cdn h THR 34 CO -0.18 0.43 -1.90 -0.62 0.37 0.00 0.00 175.52 173.62 1cdn n GLU 35 N -4.59 0.68 -3.13 6.66 -0.58 0.38 -4.72 120.64 115.34 1cdn n GLU 35 Ca -0.08 0.25 -0.19 0.00 -0.42 0.00 0.00 57.16 56.72 1cdn n GLU 35 Cb 0.40 -1.73 -0.03 0.00 -0.57 0.00 0.00 31.44 29.52 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 -3.15 -0.43 -0.35 -0.32 3.72 0.10 -4.98 117.46 112.06 1cdn n PHE 36 Ca -0.24 -3.49 0.27 0.00 -0.05 0.00 0.00 57.45 53.93 1cdn n PHE 36 Cb 1.06 -0.12 0.52 0.00 -0.94 0.00 0.00 39.48 40.00 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 3.34 0.23 -0.66 -1.08 0.11 -1.55 -2.44 132.00 129.96 1cdn h PRO 37 Ca 0.06 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1cdn h PRO 37 Cb 0.96 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.98 1cdn h PRO 37 CO 0.45 0.15 0.42 0.77 -0.21 0.00 0.00 178.00 179.58 1cdn h SER 38 N 0.24 0.78 -0.34 -2.05 0.02 -1.93 -3.09 113.55 107.18 1cdn h SER 38 Ca 0.76 -0.04 0.10 0.00 -0.84 0.00 0.00 61.79 61.77 1cdn h SER 38 Cb 1.90 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 64.23 1cdn h SER 38 CO -0.59 0.59 0.25 -0.07 -1.14 0.00 0.00 176.83 175.87 1cdn h LEU 39 N 0.90 0.00 -1.47 5.07 3.38 -1.60 0.45 115.31 122.05 1cdn h LEU 39 Ca 0.24 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.26 1cdn h LEU 39 Cb -0.06 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1cdn h LEU 39 CO -0.05 0.00 0.41 -0.07 0.09 0.00 0.00 178.44 178.83 1cdn h LEU 40 N 0.00 0.59 0.00 1.67 4.07 -1.68 -0.06 115.31 119.89 1cdn h LEU 40 Ca 0.16 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.12 1cdn h LEU 40 Cb 0.66 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.27 1cdn h LEU 40 CO -0.00 0.39 -0.09 0.29 -1.08 0.00 0.00 178.44 177.95 1cdn n LYS 41 N -4.47 0.05 -1.27 1.13 5.02 0.25 -4.04 118.16 114.82 1cdn n LYS 41 Ca 0.08 0.02 -0.37 0.00 -2.02 0.00 0.00 58.31 56.03 1cdn n LYS 41 Cb 0.19 -0.46 -0.02 0.00 -0.02 0.00 0.00 35.03 34.72 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 2.07 3.78 0.00 0.72 0.00 0.13 -4.13 105.19 107.76 1cdn n GLY 42 Ca -0.01 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.67 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 3.91 -1.97 3.60 -0.02 0.00 -1.12 -4.16 105.19 105.43 1cdn n GLY 43 Ca 0.59 0.73 0.00 0.00 0.00 0.00 0.00 46.02 47.35 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 -4.00 -0.05 0.84 1.61 0.01 -0.05 -5.03 113.70 107.04 1cdn s SER 44 Ca 0.00 -0.04 -0.11 0.00 1.31 0.00 0.00 55.95 57.11 1cdn s SER 44 Cb 0.00 0.08 0.10 0.00 0.21 0.00 0.00 66.02 66.41 1cdn s SER 44 CO 0.00 -0.14 1.09 0.42 0.41 0.00 0.00 173.24 175.02 1cdn s THR 45 N -2.22 2.93 0.16 1.44 -4.23 -1.26 -4.08 115.64 108.38 1cdn s THR 45 Ca 0.13 0.30 -0.19 0.00 -1.18 0.00 0.00 61.69 60.75 1cdn s THR 45 Cb 0.03 -2.82 0.08 0.00 1.34 0.00 0.00 72.50 71.13 1cdn s THR 45 CO -0.04 -0.40 1.64 0.25 -0.54 0.00 0.00 174.62 175.53 1cdn h LEU 46 N -1.36 -0.60 -0.08 4.79 5.85 -1.94 0.40 115.31 122.36 1cdn h LEU 46 Ca -0.47 0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.39 1cdn h LEU 46 Cb 1.26 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 42.61 1cdn h LEU 46 CO 0.54 -0.21 0.03 0.44 -0.34 0.00 0.00 178.44 178.90 1cdn h ASP 47 N -0.12 0.04 -0.21 1.25 3.32 -1.98 0.12 116.42 118.83 1cdn h ASP 47 Ca 0.18 0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.29 1cdn h ASP 47 Cb 0.39 -0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.88 1cdn h ASP 47 CO -0.43 0.04 -0.24 -0.33 -1.72 0.00 0.00 179.24 176.56 1cdn h GLU 48 N 0.08 -0.25 -0.15 3.56 5.08 -1.82 0.76 114.58 121.84 1cdn h GLU 48 Ca 0.03 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1cdn h GLU 48 Cb 0.01 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 1cdn h GLU 48 CO -0.03 -0.16 -0.19 -0.07 -1.00 0.00 0.00 179.01 177.56 1cdn h LEU 49 N -0.26 -0.59 -0.58 1.33 4.07 -0.41 0.16 115.31 119.03 1cdn h LEU 49 Ca 0.13 0.10 0.07 0.00 0.08 0.00 0.00 57.88 58.26 1cdn h LEU 49 Cb 0.45 0.27 -0.06 0.00 1.08 0.00 0.00 40.66 42.41 1cdn h LEU 49 CO -0.36 -0.24 0.27 0.15 -1.08 0.00 0.00 178.44 177.18 1cdn h PHE 50 N -0.23 0.48 -0.49 1.13 3.04 -0.15 -0.49 116.94 120.24 1cdn h PHE 50 Ca 0.11 0.03 -0.11 0.00 3.98 0.00 0.00 57.97 61.97 1cdn h PHE 50 Cb 0.38 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.75 1cdn h PHE 50 CO -0.31 0.20 -0.14 0.93 -2.02 0.00 0.00 178.31 176.97 1cdn h GLU 51 N 0.50 0.96 -0.54 1.11 5.08 -0.28 0.28 114.58 121.68 1cdn h GLU 51 Ca 0.27 -0.38 0.09 0.00 -1.00 0.00 0.00 59.36 58.35 1cdn h GLU 51 Cb 0.25 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.37 1cdn h GLU 51 CO -0.22 1.04 0.13 0.93 -1.00 0.00 0.00 179.01 179.89 1cdn h GLU 52 N 0.81 0.27 0.00 2.33 5.08 -0.01 -3.29 114.58 119.76 1cdn h GLU 52 Ca 0.12 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1cdn h GLU 52 Cb 0.70 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.89 1cdn h GLU 52 CO 0.05 0.18 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.10 1cdn h LEU 53 N 0.27 0.00 -8.14 1.33 3.38 -0.85 -3.42 115.31 107.88 1cdn h LEU 53 Ca 0.28 -0.39 -0.74 0.00 0.09 0.00 0.00 57.88 57.12 1cdn h LEU 53 Cb 0.38 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 40.87 1cdn h LEU 53 CO -0.34 0.74 -0.33 -0.62 0.09 0.00 0.00 178.44 177.97 1cdn s ASP 54 N -5.86 5.99 0.00 -0.43 2.15 0.96 -4.89 116.67 114.59 1cdn s ASP 54 Ca -0.09 -1.61 0.09 0.00 0.43 0.00 0.00 52.55 51.38 1cdn s ASP 54 Cb -0.01 -2.12 0.41 0.00 -0.30 0.00 0.00 42.92 40.90 1cdn s ASP 54 CO 0.29 -0.70 1.29 1.17 -0.17 0.00 0.00 175.17 177.05 1cdn n LYS 55 N 5.11 0.01 0.00 4.34 3.00 -1.24 -4.18 118.16 125.21 1cdn n LYS 55 Ca -0.12 0.32 0.00 0.00 -0.00 0.00 0.00 58.31 58.52 1cdn n LYS 55 Cb 0.42 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.95 1cdn n LYS 55 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1cdn n ASN 56 N -1.48 0.00 0.13 3.14 0.23 -1.26 -5.04 115.26 110.97 1cdn n ASN 56 Ca 0.03 0.00 -0.15 0.00 -0.53 0.00 0.00 54.58 53.93 1cdn n ASN 56 Cb 0.11 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 37.73 1cdn n ASN 56 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1cdn h GLY 57 N 0.00 -0.88 0.38 4.83 0.00 -1.97 -2.93 103.07 102.50 1cdn h GLY 57 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.84 1cdn h GLY 57 CO 0.00 -0.27 -0.75 2.09 0.00 0.00 0.00 176.54 177.60 1cdn n ASP 58 N -5.47 0.83 0.00 0.19 5.75 -1.26 -4.98 116.55 111.61 1cdn n ASP 58 Ca -0.08 -0.71 0.00 0.00 -0.01 0.00 0.00 54.79 54.00 1cdn n ASP 58 Cb 0.38 0.65 0.00 0.00 -1.03 0.00 0.00 41.12 41.12 1cdn n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1cdn n GLY 59 N 1.49 1.11 3.38 6.12 0.00 -1.11 -4.80 105.19 111.38 1cdn n GLY 59 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.09 1.20 -0.40 1.61 0.41 -1.26 -4.95 118.70 115.22 1cdn s GLU 60 Ca 0.00 -1.06 -0.17 0.00 -0.41 0.00 0.00 54.97 53.32 1cdn s GLU 60 Cb 0.00 0.42 0.01 0.00 -1.78 0.00 0.00 34.13 32.78 1cdn s GLU 60 CO 0.00 -0.46 0.44 0.08 -0.49 0.00 0.00 175.26 174.83 1cdn s VAL 61 N -3.93 5.08 0.64 2.63 1.01 0.49 -4.85 120.40 121.47 1cdn s VAL 61 Ca 0.14 -0.17 -0.11 0.00 0.00 0.00 0.00 61.98 61.84 1cdn s VAL 61 Cb 0.02 -4.00 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 1cdn s VAL 61 CO -0.02 -0.35 1.04 -0.94 0.00 0.00 0.00 175.10 174.83 1cdn s SER 62 N 1.80 5.98 0.25 3.32 1.04 -1.26 -0.24 113.70 124.60 1cdn s SER 62 Ca 0.13 1.30 -0.05 0.00 0.48 0.00 0.00 55.95 57.82 1cdn s SER 62 Cb -0.17 -2.28 0.32 0.00 0.10 0.00 0.00 66.02 63.99 1cdn s SER 62 CO 0.14 -1.00 1.90 0.15 0.98 0.00 0.00 173.24 175.40 1cdn h PHE 63 N -0.40 1.20 0.06 5.02 3.57 -1.97 0.06 116.94 124.48 1cdn h PHE 63 Ca -0.44 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.08 1cdn h PHE 63 Cb 1.21 -0.40 0.00 0.00 2.79 0.00 0.00 35.95 39.55 1cdn h PHE 63 CO 0.61 0.69 -0.03 1.05 -2.23 0.00 0.00 178.31 178.40 1cdn h GLU 64 N 1.24 -0.08 -0.04 1.11 9.09 -1.94 -2.23 114.58 121.74 1cdn h GLU 64 Ca 0.39 0.01 -0.13 0.00 0.05 0.00 0.00 59.36 59.68 1cdn h GLU 64 Cb 0.00 0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 27.11 1cdn h GLU 64 CO -0.13 0.03 -0.57 1.05 0.05 0.00 0.00 179.01 179.45 1cdn h GLU 65 N -0.17 0.14 -0.65 1.06 4.11 -1.86 -1.88 114.58 115.33 1cdn h GLU 65 Ca -0.01 -0.09 0.19 0.00 0.07 0.00 0.00 59.36 59.52 1cdn h GLU 65 Cb 0.15 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 1cdn h GLU 65 CO 0.01 0.67 0.55 0.35 0.07 0.00 0.00 179.01 180.66 1cdn h PHE 66 N 0.11 0.00 -0.53 2.06 3.57 -0.73 0.18 116.94 121.58 1cdn h PHE 66 Ca -0.00 0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.65 1cdn h PHE 66 Cb 1.03 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.75 1cdn h PHE 66 CO 0.01 0.00 0.39 1.96 -2.23 0.00 0.00 178.31 178.44 1cdn h GLN 67 N 0.00 0.00 -0.26 1.11 1.08 -0.72 0.43 115.11 116.75 1cdn h GLN 67 Ca 0.31 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.49 1cdn h GLN 67 Cb 1.41 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.82 1cdn h GLN 67 CO -0.00 0.00 0.10 0.28 -0.95 0.00 0.00 178.83 178.25 1cdn h VAL 68 N 0.00 1.11 -0.03 -0.54 2.07 -0.81 0.13 116.25 118.18 1cdn h VAL 68 Ca 0.25 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1cdn h VAL 68 Cb 1.03 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1cdn h VAL 68 CO -0.00 0.13 -0.08 0.25 0.02 0.00 0.00 177.57 177.89 1cdn h LEU 69 N 0.36 0.12 -0.69 2.57 6.46 -0.30 -0.30 115.31 123.53 1cdn h LEU 69 Ca 0.09 -0.58 0.14 0.00 -0.12 0.00 0.00 57.88 57.40 1cdn h LEU 69 Cb 0.09 -0.04 -0.10 0.00 -0.73 0.00 0.00 40.66 39.88 1cdn h LEU 69 CO -0.01 0.69 0.18 0.58 -0.62 0.00 0.00 178.44 179.26 1cdn h VAL 70 N -0.43 0.59 0.25 1.05 2.07 -0.79 0.14 116.25 119.12 1cdn h VAL 70 Ca -0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1cdn h VAL 70 Cb 0.67 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1cdn h VAL 70 CO 0.02 0.05 -0.25 0.50 0.02 0.00 0.00 177.57 177.91 1cdn h LYS 71 N 0.30 -0.51 -1.00 1.57 3.64 -0.61 0.13 116.57 120.09 1cdn h LYS 71 Ca 0.38 0.03 0.22 0.00 -1.27 0.00 0.00 60.65 60.01 1cdn h LYS 71 Cb 0.60 0.12 -0.10 0.00 -0.41 0.00 0.00 32.23 32.43 1cdn h LYS 71 CO -0.45 -0.34 0.62 0.87 -2.27 0.00 0.00 179.45 177.88 1cdn h LYS 72 N -0.53 0.58 0.63 1.90 6.56 0.57 -0.96 116.57 125.32 1cdn h LYS 72 Ca -0.00 -0.04 -0.03 0.00 -1.06 0.00 0.00 60.65 59.52 1cdn h LYS 72 Cb 0.49 -0.13 0.01 0.00 -0.57 0.00 0.00 32.23 32.02 1cdn h LYS 72 CO -0.06 0.39 -0.30 0.82 -2.06 0.00 0.00 179.45 178.24 1cdn h ILE 73 N 0.60 0.15 0.00 1.86 2.04 -0.42 -3.36 117.51 118.38 1cdn h ILE 73 Ca 0.59 -0.35 -0.41 0.00 1.00 0.00 0.00 64.86 65.68 1cdn h ILE 73 Cb 1.14 0.21 0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1cdn h ILE 73 CO -0.37 0.02 2.44 -0.24 0.00 0.00 0.00 178.15 180.01 1cdn n SER 74 N -5.35 5.76 0.00 1.72 2.88 0.42 -5.11 113.62 113.95 1cdn n SER 74 Ca -0.11 -2.37 0.00 0.00 -1.33 0.00 0.00 58.87 55.06 1cdn n SER 74 Cb 0.35 -1.21 0.00 0.00 -0.75 0.00 0.00 64.21 62.61 1cdn n SER 74 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81