#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 5.56 0.49 4.39 1.04 -1.26 -4.66 113.70 119.27 1cdn s SER 2 Ca 0.00 -0.18 0.34 0.00 0.48 0.00 0.00 55.95 56.58 1cdn s SER 2 Cb 0.00 -0.88 1.46 0.00 0.10 0.00 0.00 66.02 66.70 1cdn s SER 2 CO 0.00 -0.86 1.72 -0.65 0.98 0.00 0.00 173.24 174.43 1cdn h PRO 3 N 0.43 0.10 -0.05 4.02 0.11 -1.95 -0.16 132.00 134.50 1cdn h PRO 3 Ca -0.42 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 1cdn h PRO 3 Cb 1.28 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 1cdn h PRO 3 CO 0.50 0.07 -0.01 0.93 -0.21 0.00 0.00 178.00 179.27 1cdn h GLU 4 N 0.10 0.10 -0.45 1.05 5.08 -1.99 0.19 114.58 118.67 1cdn h GLU 4 Ca 0.69 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.95 1cdn h GLU 4 Cb 2.42 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 31.65 1cdn h GLU 4 CO -0.16 0.45 0.05 0.93 -1.00 0.00 0.00 179.01 179.28 1cdn h GLU 5 N -0.25 0.76 -0.85 2.33 3.07 -1.65 -1.14 114.58 116.84 1cdn h GLU 5 Ca 0.01 -0.22 0.07 0.00 -0.50 0.00 0.00 59.36 58.73 1cdn h GLU 5 Cb 0.41 -0.08 -0.06 0.00 -0.84 0.00 0.00 28.75 28.19 1cdn h GLU 5 CO 0.01 0.80 0.55 -0.07 -1.40 0.00 0.00 179.01 178.89 1cdn h LEU 6 N 0.62 0.81 0.11 1.33 3.38 -0.95 0.18 115.31 120.79 1cdn h LEU 6 Ca 0.13 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1cdn h LEU 6 Cb 0.42 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1cdn h LEU 6 CO 0.01 0.52 -0.05 0.50 0.09 0.00 0.00 178.44 179.51 1cdn h LYS 7 N 0.92 -0.14 -0.33 1.13 1.63 -0.21 0.18 116.57 119.76 1cdn h LYS 7 Ca 0.37 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 60.25 1cdn h LYS 7 Cb 0.26 0.03 -0.07 0.00 -0.60 0.00 0.00 32.23 31.85 1cdn h LYS 7 CO -0.14 -0.01 -0.13 0.78 -3.45 0.00 0.00 179.45 176.50 1cdn h GLY 8 N -0.23 0.16 0.49 5.01 0.00 0.06 0.76 103.07 109.30 1cdn h GLY 8 Ca -0.01 0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.50 1cdn h GLY 8 CO 0.02 -0.15 -0.28 -2.22 0.00 0.00 0.00 176.54 173.91 1cdn h ILE 9 N -0.07 0.39 -0.45 2.60 2.04 -0.68 0.68 117.51 122.03 1cdn h ILE 9 Ca 0.16 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.11 1cdn h ILE 9 Cb 0.31 0.39 -0.10 0.00 -0.74 0.00 0.00 36.82 36.69 1cdn h ILE 9 CO -0.37 0.00 -0.26 0.15 0.00 0.00 0.00 178.15 177.67 1cdn h PHE 10 N -0.48 -0.67 0.26 1.37 3.04 0.32 0.77 116.94 121.55 1cdn h PHE 10 Ca 0.04 0.05 -0.01 0.00 3.98 0.00 0.00 57.97 62.03 1cdn h PHE 10 Cb 0.52 0.36 0.00 0.00 2.56 0.00 0.00 35.95 39.39 1cdn h PHE 10 CO -0.26 -0.33 -0.12 0.93 -2.02 0.00 0.00 178.31 176.50 1cdn h GLU 11 N -0.17 -0.33 -0.30 1.11 5.08 -0.61 0.70 114.58 120.05 1cdn h GLU 11 Ca 0.21 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.64 1cdn h GLU 11 Cb 0.49 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.74 1cdn h GLU 11 CO -0.54 -0.18 -0.46 -0.22 -1.00 0.00 0.00 179.01 176.61 1cdn h LYS 12 N -0.41 -0.40 -0.02 2.33 3.64 -0.33 0.14 116.57 121.53 1cdn h LYS 12 Ca -0.04 0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.17 1cdn h LYS 12 Cb 0.31 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1cdn h LYS 12 CO 0.06 -0.27 -0.86 1.88 -2.27 0.00 0.00 179.45 177.99 1cdn h TYR 13 N -0.41 0.49 0.45 1.91 0.05 -0.75 -1.08 116.97 117.63 1cdn h TYR 13 Ca 0.10 -0.25 -0.02 0.00 0.05 0.00 0.00 58.73 58.61 1cdn h TYR 13 Cb 0.61 -0.06 -0.00 0.00 1.01 0.00 0.00 36.73 38.29 1cdn h TYR 13 CO -0.60 1.05 -0.30 0.00 -1.05 0.00 0.00 178.16 177.26 1cdn h ALA 14 N 0.87 -1.10 -0.88 3.88 0.00 -0.70 -3.11 119.26 118.21 1cdn h ALA 14 Ca -0.06 -0.15 0.24 0.00 0.00 0.00 0.00 54.91 54.94 1cdn h ALA 14 Cb 1.48 0.44 -0.05 0.00 0.00 0.00 0.00 17.79 19.67 1cdn h ALA 14 CO 0.14 -1.09 0.61 0.00 0.00 0.00 0.00 179.25 178.92 1cdn h ALA 15 N -1.41 2.59 -0.62 0.00 0.00 -0.64 0.29 119.26 119.47 1cdn h ALA 15 Ca -0.06 -0.01 0.18 0.00 0.00 0.00 0.00 54.91 55.02 1cdn h ALA 15 Cb 0.58 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1cdn h ALA 15 CO 0.04 -0.86 0.46 -0.22 0.00 0.00 0.00 179.25 178.67 1cdn h LYS 16 N 0.15 0.00 0.00 0.00 3.64 -1.12 -3.38 116.57 115.86 1cdn h LYS 16 Ca 0.44 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.82 1cdn h LYS 16 Cb 1.48 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.30 1cdn h LYS 16 CO -0.07 0.00 0.00 -1.91 -2.27 0.00 0.00 179.45 175.20 1cdn n GLU 17 N -4.28 0.00 -2.41 1.90 2.13 -0.54 -5.11 120.64 112.33 1cdn n GLU 17 Ca 0.12 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.84 1cdn n GLU 17 Cb 0.70 -0.29 -0.00 0.00 0.27 0.00 0.00 31.44 32.12 1cdn n GLU 17 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1cdn n GLY 18 N 1.21 2.99 3.75 8.31 0.00 0.91 -5.09 105.19 117.27 1cdn n GLY 18 Ca 0.00 -2.22 -0.41 0.00 0.00 0.00 0.00 46.02 43.38 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 -2.20 6.57 0.60 1.61 -1.08 -1.26 -3.71 116.67 117.19 1cdn s ASP 19 Ca 0.11 2.75 0.28 0.00 -0.52 0.00 0.00 52.55 55.17 1cdn s ASP 19 Cb -0.01 -2.63 1.45 0.00 -1.46 0.00 0.00 42.92 40.27 1cdn s ASP 19 CO 0.07 -0.76 1.85 1.55 0.52 0.00 0.00 175.17 178.40 1cdn h PRO 20 N 5.00 0.00 -0.06 4.34 0.13 -1.87 0.35 132.00 139.88 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 0.78 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.64 1cdn n ASN 21 N -3.55 0.71 -3.69 1.44 3.02 -1.26 -4.46 115.26 107.47 1cdn n ASN 21 Ca 0.08 -1.51 -0.10 0.00 -0.03 0.00 0.00 54.58 53.02 1cdn n ASN 21 Cb 0.68 -0.04 -0.11 0.00 -0.61 0.00 0.00 39.78 39.70 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 -1.92 0.35 -0.14 3.52 2.00 0.11 -4.10 119.66 119.48 1cdn s GLN 22 Ca 0.31 0.82 -0.17 0.00 -2.00 0.00 0.00 55.36 54.32 1cdn s GLN 22 Cb 0.16 0.04 -0.04 0.00 0.80 0.00 0.00 33.01 33.96 1cdn s GLN 22 CO 0.25 -0.18 0.41 -0.51 -0.50 0.00 0.00 175.29 174.76 1cdn s LEU 23 N 1.68 4.25 0.91 3.68 1.43 0.15 -4.32 118.68 126.47 1cdn s LEU 23 Ca -0.07 0.68 -0.14 0.00 -1.03 0.00 0.00 54.13 53.57 1cdn s LEU 23 Cb -0.09 -2.58 0.15 0.00 0.03 0.00 0.00 46.19 43.70 1cdn s LEU 23 CO -0.12 0.02 1.24 -0.94 0.23 0.00 0.00 176.35 176.77 1cdn s SER 24 N 0.63 3.56 0.19 2.29 1.04 -1.26 -0.90 113.70 119.25 1cdn s SER 24 Ca 0.22 0.55 -0.12 0.00 0.48 0.00 0.00 55.95 57.09 1cdn s SER 24 Cb -0.14 -0.83 0.15 0.00 0.10 0.00 0.00 66.02 65.29 1cdn s SER 24 CO 0.08 -2.48 1.81 0.11 0.98 0.00 0.00 173.24 173.74 1cdn h LYS 25 N -1.46 0.61 -0.43 4.02 1.57 -1.98 -0.02 116.57 118.88 1cdn h LYS 25 Ca -0.46 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.21 1cdn h LYS 25 Cb 1.28 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1cdn h LYS 25 CO 0.51 0.41 -0.04 0.93 -0.57 0.00 0.00 179.45 180.68 1cdn h GLU 26 N 0.63 0.78 -0.13 3.15 5.08 -1.98 0.23 114.58 122.34 1cdn h GLU 26 Ca 0.24 -0.27 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1cdn h GLU 26 Cb 0.09 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1cdn h GLU 26 CO -0.13 0.88 0.02 0.93 -1.00 0.00 0.00 179.01 179.70 1cdn h GLU 27 N 0.61 0.07 -0.81 2.33 5.08 -1.81 0.51 114.58 120.57 1cdn h GLU 27 Ca 0.12 -0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.58 1cdn h GLU 27 Cb 0.55 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.70 1cdn h GLU 27 CO 0.03 0.05 0.44 -0.07 -1.00 0.00 0.00 179.01 178.46 1cdn h LEU 28 N 0.07 0.59 0.30 1.33 3.38 -0.71 0.33 115.31 120.60 1cdn h LEU 28 Ca 0.06 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1cdn h LEU 28 Cb 0.06 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1cdn h LEU 28 CO -0.09 0.31 -0.15 0.50 0.09 0.00 0.00 178.44 179.11 1cdn h LYS 29 N 0.70 -0.39 -0.54 1.13 3.64 0.63 0.26 116.57 122.00 1cdn h LYS 29 Ca 0.41 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.84 1cdn h LYS 29 Cb 0.46 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.34 1cdn h LYS 29 CO -0.29 -0.25 0.34 -0.07 -2.27 0.00 0.00 179.45 176.91 1cdn h LEU 30 N -0.43 0.56 0.01 5.20 4.07 -0.74 0.13 115.31 124.10 1cdn h LEU 30 Ca -0.04 -0.00 0.03 0.00 0.08 0.00 0.00 57.88 57.94 1cdn h LEU 30 Cb 0.33 -0.12 -0.06 0.00 1.08 0.00 0.00 40.66 41.89 1cdn h LEU 30 CO 0.07 0.40 -0.44 0.25 -1.08 0.00 0.00 178.44 177.63 1cdn h LEU 31 N 0.68 -1.35 0.05 1.67 6.46 -0.70 -0.75 115.31 121.36 1cdn h LEU 31 Ca 0.21 0.16 0.02 0.00 -0.12 0.00 0.00 57.88 58.16 1cdn h LEU 31 Cb -0.02 0.53 -0.04 0.00 -0.73 0.00 0.00 40.66 40.40 1cdn h LEU 31 CO -0.08 -0.48 -0.25 -0.07 -0.62 0.00 0.00 178.44 176.95 1cdn h LEU 32 N -0.60 -0.72 -0.32 2.25 3.38 -0.03 0.62 115.31 119.89 1cdn h LEU 32 Ca 0.04 0.09 0.07 0.00 0.09 0.00 0.00 57.88 58.17 1cdn h LEU 32 Cb 0.67 0.29 -0.08 0.00 0.09 0.00 0.00 40.66 41.63 1cdn h LEU 32 CO -0.32 -0.32 -0.25 1.56 0.09 0.00 0.00 178.44 179.19 1cdn h GLN 33 N -0.41 -0.21 -0.01 1.13 4.20 -0.56 0.23 115.11 119.49 1cdn h GLN 33 Ca 0.05 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 1cdn h GLN 33 Cb 0.47 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1cdn h GLN 33 CO -0.19 -0.14 -0.03 1.15 -0.67 0.00 0.00 178.83 178.96 1cdn h THR 34 N -0.22 1.52 0.01 -0.54 2.02 -0.82 -3.37 112.91 111.51 1cdn h THR 34 Ca 0.16 -1.57 -0.34 0.00 0.77 0.00 0.00 66.41 65.44 1cdn h THR 34 Cb 0.47 2.56 -0.06 0.00 -1.74 0.00 0.00 68.15 69.39 1cdn h THR 34 CO -0.45 0.41 -2.11 -0.62 0.37 0.00 0.00 175.52 173.12 1cdn n GLU 35 N -4.74 0.67 -3.12 6.66 -0.58 0.18 -4.76 120.64 114.95 1cdn n GLU 35 Ca -0.09 0.13 -0.20 0.00 -0.42 0.00 0.00 57.16 56.58 1cdn n GLU 35 Cb 0.34 -1.63 -0.04 0.00 -0.57 0.00 0.00 31.44 29.54 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 -2.93 -0.65 -0.31 -0.32 3.72 0.79 -4.93 117.46 112.83 1cdn n PHE 36 Ca -0.27 -3.37 0.28 0.00 -0.05 0.00 0.00 57.45 54.04 1cdn n PHE 36 Cb 1.10 -0.06 0.63 0.00 -0.94 0.00 0.00 39.48 40.21 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 3.64 0.19 0.20 -1.08 0.11 -1.63 0.21 132.00 133.64 1cdn h PRO 37 Ca 0.05 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.16 1cdn h PRO 37 Cb 0.94 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.97 1cdn h PRO 37 CO 0.44 0.13 -0.39 0.66 -0.21 0.00 0.00 178.00 178.63 1cdn h SER 38 N 0.20 -1.12 -0.65 -2.05 4.64 -1.92 -0.10 113.55 112.55 1cdn h SER 38 Ca 0.57 0.12 -0.09 0.00 -0.47 0.00 0.00 61.79 61.92 1cdn h SER 38 Cb 1.84 0.41 -0.02 0.00 -0.31 0.00 0.00 62.40 64.32 1cdn h SER 38 CO -0.16 -0.49 0.07 -0.07 -0.87 0.00 0.00 176.83 175.31 1cdn h LEU 39 N -0.68 1.06 -0.41 5.97 3.38 -1.52 0.17 115.31 123.29 1cdn h LEU 39 Ca 0.01 -0.27 0.08 0.00 0.09 0.00 0.00 57.88 57.78 1cdn h LEU 39 Cb 0.67 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.06 1cdn h LEU 39 CO -0.18 1.07 -0.05 0.25 0.09 0.00 0.00 178.44 179.62 1cdn h LEU 40 N 1.02 -0.28 0.20 1.67 5.85 -0.62 -2.44 115.31 120.70 1cdn h LEU 40 Ca 0.19 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 59.01 1cdn h LEU 40 Cb 0.49 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.73 1cdn h LEU 40 CO 0.02 -0.10 -0.10 0.11 -0.34 0.00 0.00 178.44 178.04 1cdn h LYS 41 N 0.05 -0.26 -2.96 1.25 1.57 -0.89 -3.34 116.57 111.98 1cdn h LYS 41 Ca 0.20 0.02 -0.46 0.00 -1.87 0.00 0.00 60.65 58.54 1cdn h LYS 41 Cb 0.30 0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.67 1cdn h LYS 41 CO -0.38 0.08 2.53 0.41 -0.57 0.00 0.00 179.45 181.52 1cdn n GLY 42 N -0.22 3.51 3.15 3.86 0.00 0.59 -4.59 105.19 111.48 1cdn n GLY 42 Ca -0.09 -1.17 0.04 0.00 0.00 0.00 0.00 46.02 44.81 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 2.59 -1.15 0.28 -0.02 0.00 -1.15 -4.77 107.32 103.09 1cdn s GLY 43 Ca 0.56 1.38 -0.06 0.00 0.00 0.00 0.00 44.72 46.61 1cdn s GLY 43 CO -0.04 3.61 1.58 1.76 0.00 0.00 0.00 173.10 180.01 1cdn h SER 44 N 7.97 -0.70 -5.07 1.64 0.02 -1.91 -3.39 113.55 112.11 1cdn h SER 44 Ca -0.09 0.27 -0.12 0.00 -0.84 0.00 0.00 61.79 61.02 1cdn h SER 44 Cb 1.18 0.53 -0.18 0.00 0.14 0.00 0.00 62.40 64.07 1cdn h SER 44 CO 0.17 -0.30 -0.43 0.42 -1.14 0.00 0.00 176.83 175.55 1cdn s THR 45 N -6.17 0.11 0.23 -2.27 -4.23 -1.26 -5.01 115.64 97.04 1cdn s THR 45 Ca -0.14 -0.93 -0.06 0.00 -1.18 0.00 0.00 61.69 59.38 1cdn s THR 45 Cb 0.26 -0.88 0.20 0.00 1.34 0.00 0.00 72.50 73.42 1cdn s THR 45 CO 0.77 -0.51 1.84 -0.07 -0.54 0.00 0.00 174.62 176.11 1cdn h LEU 46 N 3.55 0.75 0.14 4.79 3.38 -1.94 -1.19 115.31 124.79 1cdn h LEU 46 Ca -0.32 0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.69 1cdn h LEU 46 Cb 1.19 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 1cdn h LEU 46 CO 0.48 0.48 -0.39 0.44 0.09 0.00 0.00 178.44 179.54 1cdn h ASP 47 N 0.89 -1.15 -0.55 -0.43 5.19 -1.96 0.27 116.42 118.68 1cdn h ASP 47 Ca 0.36 0.13 0.07 0.00 -0.62 0.00 0.00 57.03 56.96 1cdn h ASP 47 Cb 0.19 0.43 -0.06 0.00 0.18 0.00 0.00 39.33 40.07 1cdn h ASP 47 CO -0.18 -0.48 0.23 -0.33 -3.12 0.00 0.00 179.24 175.37 1cdn h GLU 48 N -0.64 0.42 -0.15 3.56 4.39 -1.87 0.38 114.58 120.68 1cdn h GLU 48 Ca 0.02 -0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.72 1cdn h GLU 48 Cb 0.66 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.19 1cdn h GLU 48 CO -0.22 0.28 -0.04 1.25 -1.16 0.00 0.00 179.01 179.13 1cdn h LEU 49 N 0.44 -0.14 -0.17 1.33 6.46 -0.75 0.86 115.31 123.34 1cdn h LEU 49 Ca 0.26 0.04 0.04 0.00 -0.12 0.00 0.00 57.88 58.11 1cdn h LEU 49 Cb 0.26 0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.24 1cdn h LEU 49 CO -0.23 -0.05 -0.09 0.15 -0.62 0.00 0.00 178.44 177.60 1cdn h PHE 50 N 0.00 -0.20 -0.70 1.25 3.57 0.23 -0.50 116.94 120.58 1cdn h PHE 50 Ca 0.07 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.61 1cdn h PHE 50 Cb 0.11 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 1cdn h PHE 50 CO -0.18 -0.14 0.45 0.93 -2.23 0.00 0.00 178.31 177.14 1cdn h GLU 51 N -0.07 0.88 -0.69 1.11 4.39 -0.70 0.14 114.58 119.64 1cdn h GLU 51 Ca 0.10 -0.05 0.10 0.00 0.34 0.00 0.00 59.36 59.84 1cdn h GLU 51 Cb 0.21 -0.20 -0.07 0.00 -0.10 0.00 0.00 28.75 28.59 1cdn h GLU 51 CO -0.22 0.58 0.33 1.49 -1.16 0.00 0.00 179.01 180.03 1cdn h GLU 52 N 0.91 0.53 0.43 2.33 4.22 0.25 -2.95 114.58 120.29 1cdn h GLU 52 Ca 0.27 -0.03 -0.02 0.00 0.08 0.00 0.00 59.36 59.65 1cdn h GLU 52 Cb -0.05 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1cdn h GLU 52 CO -0.08 0.35 -0.21 -0.07 -2.18 0.00 0.00 179.01 176.83 1cdn h LEU 53 N 0.55 -0.49 -8.22 1.64 3.38 -0.57 -3.41 115.31 108.19 1cdn h LEU 53 Ca 0.35 0.02 -0.74 0.00 0.09 0.00 0.00 57.88 57.59 1cdn h LEU 53 Cb 0.39 0.13 -0.23 0.00 0.09 0.00 0.00 40.66 41.04 1cdn h LEU 53 CO -0.29 -0.16 -0.26 -0.62 0.09 0.00 0.00 178.44 177.21 1cdn s ASP 54 N -4.27 6.17 -0.93 -0.43 2.15 0.45 -4.86 116.67 114.96 1cdn s ASP 54 Ca -0.08 -1.49 -0.22 0.00 0.43 0.00 0.00 52.55 51.19 1cdn s ASP 54 Cb 0.01 -2.20 -0.13 0.00 -0.30 0.00 0.00 42.92 40.30 1cdn s ASP 54 CO 0.25 -0.76 1.93 0.29 -0.17 0.00 0.00 175.17 176.72 1cdn n LYS 55 N 5.30 1.62 -3.32 4.34 4.76 -1.12 -4.21 118.16 125.53 1cdn n LYS 55 Ca -0.13 -2.09 -0.21 0.00 -2.87 0.00 0.00 58.31 53.01 1cdn n LYS 55 Cb 0.42 -3.18 -0.04 0.00 -1.84 0.00 0.00 35.03 30.39 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 9.50 -1.27 0.00 4.39 2.04 -1.26 -4.88 115.26 123.78 1cdn n ASN 56 Ca 0.48 -0.43 0.00 0.00 -0.44 0.00 0.00 54.58 54.19 1cdn n ASN 56 Cb 0.42 -1.16 0.00 0.00 -2.53 0.00 0.00 39.78 36.51 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 -0.75 1.42 0.07 4.83 0.00 -1.26 -4.66 105.19 104.83 1cdn n GLY 57 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 1cdn n GLY 57 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1cdn n ASP 58 N -0.65 0.67 0.00 1.61 5.75 -1.26 -4.98 116.55 117.69 1cdn n ASP 58 Ca 0.00 0.07 0.00 0.00 -0.01 0.00 0.00 54.79 54.85 1cdn n ASP 58 Cb 0.00 0.61 0.00 0.00 -1.03 0.00 0.00 41.12 40.70 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 1.29 0.50 3.66 6.12 0.00 -1.26 -5.01 105.19 110.49 1cdn n GLY 59 Ca 0.01 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.21 1.82 -0.33 1.61 2.02 -1.26 -4.94 118.70 116.41 1cdn s GLU 60 Ca 0.00 -1.35 -0.04 0.00 0.02 0.00 0.00 54.97 53.60 1cdn s GLU 60 Cb 0.00 0.52 0.05 0.00 0.10 0.00 0.00 34.13 34.81 1cdn s GLU 60 CO 0.00 -0.79 0.08 0.08 0.02 0.00 0.00 175.26 174.64 1cdn s VAL 61 N -3.43 3.40 0.65 2.63 1.01 -0.08 -4.79 120.40 119.79 1cdn s VAL 61 Ca 0.21 -1.36 -0.12 0.00 0.00 0.00 0.00 61.98 60.71 1cdn s VAL 61 Cb -0.03 -2.99 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 1cdn s VAL 61 CO 0.12 -0.22 1.05 -0.44 0.00 0.00 0.00 175.10 175.61 1cdn s SER 62 N 1.42 5.70 0.18 3.32 0.01 -1.26 -0.67 113.70 122.39 1cdn s SER 62 Ca -0.02 1.60 -0.14 0.00 1.31 0.00 0.00 55.95 58.70 1cdn s SER 62 Cb -0.20 -2.50 0.17 0.00 0.21 0.00 0.00 66.02 63.70 1cdn s SER 62 CO 0.00 -1.23 1.70 0.15 0.41 0.00 0.00 173.24 174.28 1cdn h PHE 63 N -0.36 0.06 0.00 2.43 3.57 -1.97 0.79 116.94 121.47 1cdn h PHE 63 Ca -0.44 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.08 1cdn h PHE 63 Cb 1.21 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.99 1cdn h PHE 63 CO 0.62 -0.05 -0.04 1.05 -2.23 0.00 0.00 178.31 177.66 1cdn h GLU 64 N 0.17 0.00 0.09 1.11 9.09 -1.95 0.20 114.58 123.29 1cdn h GLU 64 Ca 0.23 0.00 -0.35 0.00 0.05 0.00 0.00 59.36 59.29 1cdn h GLU 64 Cb 0.33 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.40 1cdn h GLU 64 CO -0.35 0.04 -1.96 -0.85 0.05 0.00 0.00 179.01 175.94 1cdn n GLU 65 N -3.84 0.73 -0.22 1.06 0.28 -0.58 -3.70 120.64 114.37 1cdn n GLU 65 Ca -0.03 0.26 0.23 0.00 -0.16 0.00 0.00 57.16 57.46 1cdn n GLU 65 Cb 0.13 -1.72 0.59 0.00 1.43 0.00 0.00 31.44 31.86 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 0.05 0.36 -0.18 -1.84 3.04 -0.16 0.59 116.94 118.80 1cdn h PHE 66 Ca -0.40 0.01 0.05 0.00 3.98 0.00 0.00 57.97 61.61 1cdn h PHE 66 Cb 2.03 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 40.42 1cdn h PHE 66 CO 0.06 0.08 0.33 1.96 -2.02 0.00 0.00 178.31 178.73 1cdn h GLN 67 N 0.26 0.00 -0.37 1.11 1.08 -0.71 0.38 115.11 116.85 1cdn h GLN 67 Ca 0.46 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.63 1cdn h GLN 67 Cb 1.37 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.78 1cdn h GLN 67 CO -0.13 0.00 0.09 0.28 -0.95 0.00 0.00 178.83 178.13 1cdn h VAL 68 N 0.00 1.17 -0.19 -0.54 2.07 -1.07 0.22 116.25 117.91 1cdn h VAL 68 Ca 0.09 -0.60 -0.15 0.00 0.82 0.00 0.00 66.70 66.85 1cdn h VAL 68 Cb 0.75 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1cdn h VAL 68 CO -0.00 0.22 -0.48 0.25 0.02 0.00 0.00 177.57 177.58 1cdn h LEU 69 N 0.54 0.76 -0.89 2.57 6.46 -0.41 -1.61 115.31 122.72 1cdn h LEU 69 Ca 0.13 -0.57 0.04 0.00 -0.12 0.00 0.00 57.88 57.35 1cdn h LEU 69 Cb 0.20 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 39.86 1cdn h LEU 69 CO -0.00 1.19 0.58 0.58 -0.62 0.00 0.00 178.44 180.16 1cdn h VAL 70 N 0.36 1.13 -0.11 1.05 2.07 -0.99 0.68 116.25 120.44 1cdn h VAL 70 Ca -0.01 -0.38 0.04 0.00 0.82 0.00 0.00 66.70 67.18 1cdn h VAL 70 Cb 1.09 -0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.74 1cdn h VAL 70 CO 0.10 0.20 -0.18 0.50 0.02 0.00 0.00 177.57 178.22 1cdn h LYS 71 N 1.11 -0.23 -0.62 1.57 1.63 -0.30 0.35 116.57 120.08 1cdn h LYS 71 Ca 0.36 0.02 0.12 0.00 -0.85 0.00 0.00 60.65 60.30 1cdn h LYS 71 Cb 0.03 0.05 -0.09 0.00 -0.60 0.00 0.00 32.23 31.62 1cdn h LYS 71 CO -0.13 -0.15 0.12 0.87 -3.45 0.00 0.00 179.45 176.71 1cdn h LYS 72 N -0.24 0.24 -0.90 1.90 6.56 -0.47 -0.21 116.57 123.46 1cdn h LYS 72 Ca 0.09 -0.01 0.03 0.00 -1.06 0.00 0.00 60.65 59.69 1cdn h LYS 72 Cb 0.37 -0.05 -0.05 0.00 -0.57 0.00 0.00 32.23 31.93 1cdn h LYS 72 CO -0.25 0.16 0.59 0.82 -2.06 0.00 0.00 179.45 178.70 1cdn h ILE 73 N 0.24 1.18 0.00 1.86 2.04 0.04 -3.46 117.51 119.41 1cdn h ILE 73 Ca 0.33 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1cdn h ILE 73 Cb 0.50 -0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1cdn h ILE 73 CO -0.43 0.21 0.00 -1.54 0.00 0.00 0.00 178.15 176.39 1cdn n SER 74 N -4.43 0.00 0.00 1.72 3.41 0.11 -5.09 113.62 109.35 1cdn n SER 74 Ca 0.11 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.81 1cdn n SER 74 Cb 0.07 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 64.53 1cdn n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88