#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cdk n GLY 4 N 0.00 1.04 0.09 3.03 0.00 -1.26 -4.66 105.19 103.44 3cdk n GLY 4 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 3cdk n GLY 4 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cdk n LYS 5 N -0.55 0.23 -1.82 1.61 5.02 -0.53 -4.88 118.16 117.24 3cdk n LYS 5 Ca 0.00 0.19 -0.42 0.00 -2.02 0.00 0.00 58.31 56.06 3cdk n LYS 5 Cb 0.00 -1.77 -0.03 0.00 -0.02 0.00 0.00 35.03 33.21 3cdk n LYS 5 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3cdk s VAL 6 N -3.09 2.40 0.18 -0.18 1.01 -1.26 -2.28 120.40 117.18 3cdk s VAL 6 Ca 0.11 0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.35 3cdk s VAL 6 Cb 0.13 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 3cdk s VAL 6 CO 0.59 0.01 0.23 -0.76 0.00 0.00 0.00 175.10 175.17 3cdk s LEU 7 N 1.52 4.07 0.18 3.92 1.43 0.73 -4.87 118.68 125.67 3cdk s LEU 7 Ca 0.74 -0.01 -0.10 0.00 -1.03 0.00 0.00 54.13 53.73 3cdk s LEU 7 Cb -0.46 -2.65 0.08 0.00 0.03 0.00 0.00 46.19 43.19 3cdk s LEU 7 CO 0.32 0.03 1.67 0.77 0.23 0.00 0.00 176.35 179.38 3cdk h SER 8 N 2.00 0.99 -5.07 2.29 4.64 -1.95 -3.43 113.55 113.01 3cdk h SER 8 Ca -0.49 -0.26 -0.09 0.00 -0.47 0.00 0.00 61.79 60.48 3cdk h SER 8 Cb 1.21 -0.26 -0.16 0.00 -0.31 0.00 0.00 62.40 62.87 3cdk h SER 8 CO 0.64 1.00 -0.27 -0.94 -0.87 0.00 0.00 176.83 176.39 3cdk s SER 9 N -6.41 -0.07 0.20 4.97 1.04 -1.26 -4.90 113.70 107.27 3cdk s SER 9 Ca -0.12 -0.30 -0.10 0.00 0.48 0.00 0.00 55.95 55.91 3cdk s SER 9 Cb 0.13 0.36 0.23 0.00 0.10 0.00 0.00 66.02 66.84 3cdk s SER 9 CO 0.84 -0.65 1.79 0.28 0.98 0.00 0.00 173.24 176.47 3cdk h SER 10 N 3.09 0.42 -0.01 7.02 0.02 -1.92 -2.82 113.55 119.37 3cdk h SER 10 Ca -0.32 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 60.69 3cdk h SER 10 Cb 1.20 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.67 3cdk h SER 10 CO 0.48 0.27 -0.17 0.50 -1.14 0.00 0.00 176.83 176.77 3cdk h LYS 11 N 0.57 -0.27 -0.93 3.45 3.64 -1.93 -0.74 116.57 120.36 3cdk h LYS 11 Ca 0.28 0.02 0.20 0.00 -1.27 0.00 0.00 60.65 59.88 3cdk h LYS 11 Cb 0.23 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.03 3cdk h LYS 11 CO -0.21 -0.18 0.61 1.49 -2.27 0.00 0.00 179.45 178.89 3cdk h GLU 12 N -0.28 0.46 0.13 1.90 4.81 -1.93 -2.19 114.58 117.49 3cdk h GLU 12 Ca 0.06 -0.03 -0.28 0.00 -0.13 0.00 0.00 59.36 58.97 3cdk h GLU 12 Cb 0.35 -0.10 0.02 0.00 0.63 0.00 0.00 28.75 29.64 3cdk h GLU 12 CO -0.17 0.30 -1.23 0.00 -0.73 0.00 0.00 179.01 177.18 3cdk h ALA 13 N 1.61 0.07 -0.55 2.92 0.00 -1.12 -3.19 119.26 119.00 3cdk h ALA 13 Ca 0.49 -0.82 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 3cdk h ALA 13 Cb 1.14 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 3cdk h ALA 13 CO -0.21 0.81 0.32 0.00 0.00 0.00 0.00 179.25 180.17 3cdk h ALA 14 N 0.45 1.52 0.00 0.00 0.00 -0.53 -2.36 119.26 118.33 3cdk h ALA 14 Ca -0.16 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3cdk h ALA 14 Cb 1.92 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.49 3cdk h ALA 14 CO 0.22 0.41 0.18 1.63 0.00 0.00 0.00 179.25 181.69 3cdk n LYS 15 N -4.41 0.03 -0.29 0.00 5.02 -1.03 -0.05 118.16 117.42 3cdk n LYS 15 Ca 0.05 0.41 0.10 0.00 -2.02 0.00 0.00 58.31 56.85 3cdk n LYS 15 Cb 0.09 -1.78 0.27 0.00 -0.02 0.00 0.00 35.03 33.59 3cdk n LYS 15 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3cdk n LEU 16 N -1.55 3.20 -4.31 -0.35 4.77 -0.89 -4.85 117.00 113.02 3cdk n LEU 16 Ca -0.00 -1.57 -0.32 0.00 -0.03 0.00 0.00 56.01 54.08 3cdk n LEU 16 Cb 0.19 -0.38 -0.16 0.00 -2.33 0.00 0.00 43.42 40.74 3cdk n LEU 16 CO 0.02 0.79 -0.53 -0.63 -1.33 0.00 0.00 177.39 175.71 3cdk s ILE 17 N -1.24 2.37 0.15 -0.08 1.01 0.93 -5.00 121.20 119.34 3cdk s ILE 17 Ca 0.40 -0.94 0.09 0.00 0.00 0.00 0.00 60.65 60.19 3cdk s ILE 17 Cb 0.21 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 3cdk s ILE 17 CO 0.28 0.56 -0.19 -1.00 0.00 0.00 0.00 174.94 174.59 3cdk s HIS 18 N -0.11 1.85 0.18 3.97 3.76 -1.26 -4.95 115.29 118.72 3cdk s HIS 18 Ca -0.04 -0.45 -0.33 0.00 -0.15 0.00 0.00 55.06 54.09 3cdk s HIS 18 Cb -0.14 -0.94 -0.15 0.00 1.11 0.00 0.00 32.58 32.45 3cdk s HIS 18 CO 0.04 0.31 1.19 -0.25 -0.85 0.00 0.00 174.74 175.18 3cdk n ASP 19 N 0.48 1.48 -0.01 1.40 8.00 -1.26 -2.02 116.55 124.63 3cdk n ASP 19 Ca -0.15 1.14 -0.00 0.00 0.71 0.00 0.00 54.79 56.49 3cdk n ASP 19 Cb 0.56 -1.23 -0.00 0.00 -0.02 0.00 0.00 41.12 40.43 3cdk n ASP 19 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cdk n GLY 20 N 2.04 0.46 3.81 0.44 0.00 0.12 -4.99 105.19 107.08 3cdk n GLY 20 Ca 0.15 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 3cdk n GLY 20 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3cdk s ASP 21 N -2.06 5.67 -0.12 1.61 1.11 -0.86 -4.71 116.67 117.32 3cdk s ASP 21 Ca 0.00 1.72 -0.22 0.00 0.18 0.00 0.00 52.55 54.24 3cdk s ASP 21 Cb 0.00 -2.52 -0.03 0.00 1.07 0.00 0.00 42.92 41.44 3cdk s ASP 21 CO 0.00 -1.24 0.64 -0.89 1.18 0.00 0.00 175.17 174.85 3cdk s THR 22 N -2.70 5.06 -0.09 -1.27 2.01 -1.26 0.34 115.64 117.73 3cdk s THR 22 Ca 0.61 1.27 0.03 0.00 0.31 0.00 0.00 61.69 63.92 3cdk s THR 22 Cb -0.15 -3.97 0.01 0.00 0.01 0.00 0.00 72.50 68.40 3cdk s THR 22 CO 0.44 0.22 -0.19 -0.22 -0.69 0.00 0.00 174.62 174.18 3cdk s LEU 23 N 1.12 1.90 -0.14 4.42 2.96 0.29 -0.59 118.68 128.64 3cdk s LEU 23 Ca 0.33 -0.46 -0.02 0.00 -0.22 0.00 0.00 54.13 53.76 3cdk s LEU 23 Cb -0.17 -1.18 -0.02 0.00 0.50 0.00 0.00 46.19 45.32 3cdk s LEU 23 CO 0.14 0.10 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.57 3cdk s ILE 24 N 0.54 3.66 -0.06 6.68 1.01 0.04 -0.08 121.20 132.99 3cdk s ILE 24 Ca -0.16 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.06 3cdk s ILE 24 Cb -0.17 -2.57 0.01 0.00 0.01 0.00 0.00 42.46 39.74 3cdk s ILE 24 CO 0.06 0.52 -0.11 0.00 0.00 0.00 0.00 174.94 175.40 3cdk s ALA 25 N 0.18 1.16 0.96 9.38 0.00 0.70 -1.08 121.76 133.06 3cdk s ALA 25 Ca -0.03 -0.35 -0.12 0.00 0.00 0.00 0.00 51.96 51.45 3cdk s ALA 25 Cb -0.14 -0.55 0.17 0.00 0.00 0.00 0.00 23.12 22.60 3cdk s ALA 25 CO 0.03 0.09 1.10 0.20 0.00 0.00 0.00 175.76 177.18 3cdk s GLY 26 N 0.72 1.58 0.00 0.00 0.00 -0.87 -4.36 107.32 104.39 3cdk s GLY 26 Ca -0.14 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.25 3cdk s GLY 26 CO 0.03 0.25 0.00 0.61 0.00 0.00 0.00 173.10 173.99 3cdk n GLY 27 N -1.31 3.55 2.99 0.20 0.00 -1.17 -4.56 105.19 104.89 3cdk n GLY 27 Ca 0.06 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.16 3cdk n GLY 27 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3cdk s PHE 28 N -1.54 2.41 0.00 1.61 5.36 -0.04 -4.45 117.98 121.33 3cdk s PHE 28 Ca 0.00 -1.60 0.00 0.00 -0.96 0.00 0.00 56.93 54.37 3cdk s PHE 28 Cb 0.00 -1.63 0.00 0.00 -0.34 0.00 0.00 43.02 41.05 3cdk s PHE 28 CO 0.00 -0.74 0.00 0.41 -1.46 0.00 0.00 175.22 173.43 3cdk n GLY 29 N 4.69 3.96 1.05 13.12 0.00 -1.26 -1.05 105.19 125.69 3cdk n GLY 29 Ca -0.14 0.14 0.08 0.00 0.00 0.00 0.00 46.02 46.09 3cdk n GLY 29 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3cdk n LEU 30 N 0.00 3.90 -4.58 0.99 4.77 -1.26 -4.51 117.00 116.32 3cdk n LEU 30 Ca 0.00 -2.51 -0.38 0.00 -0.03 0.00 0.00 56.01 53.09 3cdk n LEU 30 Cb 0.00 -0.46 -0.11 0.00 -2.33 0.00 0.00 43.42 40.52 3cdk n LEU 30 CO 0.00 0.73 -0.19 0.00 -1.33 0.00 0.00 177.39 176.61 3cdk n GLY 32 N 4.92 -0.35 3.90 0.00 0.00 -1.26 -0.86 105.19 111.55 3cdk n GLY 32 Ca -0.14 0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 3cdk n GLY 32 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3cdk s ILE 33 N -3.29 5.38 -1.38 -0.61 -4.36 -1.26 -3.07 121.20 112.61 3cdk s ILE 33 Ca 0.42 -0.14 -0.15 0.00 -0.26 0.00 0.00 60.65 60.52 3cdk s ILE 33 Cb -0.18 -3.57 0.07 0.00 1.25 0.00 0.00 42.46 40.02 3cdk s ILE 33 CO 0.64 0.27 2.00 -0.81 0.24 0.00 0.00 174.94 177.29 3cdk n PRO 34 N 0.76 3.05 -0.17 0.37 -0.04 -1.26 -4.80 135.00 132.90 3cdk n PRO 34 Ca -0.09 -2.95 -0.04 0.00 -0.04 0.00 0.00 63.50 60.38 3cdk n PRO 34 Cb 0.52 -3.32 0.03 0.00 -0.04 0.00 0.00 33.50 30.68 3cdk n PRO 34 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 3cdk h GLU 35 N 6.56 -0.10 0.38 0.54 4.11 -1.96 0.01 114.58 124.11 3cdk h GLU 35 Ca 0.51 0.01 -0.02 0.00 0.07 0.00 0.00 59.36 59.92 3cdk h GLU 35 Cb 0.73 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.00 3cdk h GLU 35 CO 1.70 -0.07 -0.18 1.96 0.07 0.00 0.00 179.01 182.49 3cdk h GLN 36 N -0.11 -0.49 -0.89 1.06 1.08 -1.97 0.18 115.11 113.97 3cdk h GLN 36 Ca 0.24 0.03 0.17 0.00 -1.45 0.00 0.00 58.65 57.65 3cdk h GLN 36 Cb 0.49 0.11 -0.17 0.00 -0.05 0.00 0.00 27.48 27.86 3cdk h GLN 36 CO -0.60 -0.19 -0.25 -0.07 -0.95 0.00 0.00 178.83 176.78 3cdk h LEU 37 N -0.79 -0.92 -0.45 1.46 4.07 -1.88 0.20 115.31 116.99 3cdk h LEU 37 Ca -0.05 0.27 0.00 0.00 0.08 0.00 0.00 57.88 58.18 3cdk h LEU 37 Cb 0.53 0.58 -0.02 0.00 1.08 0.00 0.00 40.66 42.83 3cdk h LEU 37 CO 0.08 -0.30 0.29 0.40 -1.08 0.00 0.00 178.44 177.84 3cdk h ILE 38 N -0.01 1.12 -0.68 1.22 2.04 -0.56 -2.10 117.51 118.55 3cdk h ILE 38 Ca 0.41 -0.25 0.13 0.00 1.00 0.00 0.00 64.86 66.15 3cdk h ILE 38 Cb 0.64 0.48 -0.09 0.00 -0.74 0.00 0.00 36.82 37.12 3cdk h ILE 38 CO -0.92 0.12 0.22 -0.07 0.00 0.00 0.00 178.15 177.50 3cdk h LEU 39 N 0.61 0.15 -0.20 1.44 4.07 0.12 -1.08 115.31 120.42 3cdk h LEU 39 Ca 0.16 0.11 -0.01 0.00 0.08 0.00 0.00 57.88 58.22 3cdk h LEU 39 Cb -0.05 0.12 -0.00 0.00 1.08 0.00 0.00 40.66 41.80 3cdk h LEU 39 CO -0.03 0.06 -0.05 0.77 -1.08 0.00 0.00 178.44 178.11 3cdk h SER 40 N 0.36 0.00 0.22 -0.43 4.64 -0.76 -1.38 113.55 116.21 3cdk h SER 40 Ca 0.36 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.44 3cdk h SER 40 Cb 0.54 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.64 3cdk h SER 40 CO -0.40 0.05 -0.99 0.40 -0.87 0.00 0.00 176.83 175.02 3cdk h ILE 41 N 0.00 1.36 -0.72 0.95 2.04 -0.91 0.11 117.51 120.34 3cdk h ILE 41 Ca -0.00 -2.39 0.00 0.00 1.00 0.00 0.00 64.86 63.47 3cdk h ILE 41 Cb 0.97 2.42 -0.04 0.00 -0.74 0.00 0.00 36.82 39.44 3cdk h ILE 41 CO 0.01 0.72 0.45 -0.09 0.00 0.00 0.00 178.15 179.24 3cdk h ARG 42 N 0.29 0.96 0.00 2.37 1.12 -0.89 -2.43 114.38 115.80 3cdk h ARG 42 Ca -0.10 -0.07 -0.05 0.00 -1.11 0.00 0.00 59.98 58.65 3cdk h ARG 42 Cb 1.63 -0.21 -0.01 0.00 -0.01 0.00 0.00 29.97 31.38 3cdk h ARG 42 CO 0.18 0.66 -0.24 -0.44 -3.11 0.00 0.00 179.97 177.02 3cdk h ASP 43 N 0.97 0.00 1.71 -3.80 5.19 -1.09 -2.59 116.42 116.81 3cdk h ASP 43 Ca 0.26 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.67 3cdk h ASP 43 Cb -0.07 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.44 3cdk h ASP 43 CO -0.05 0.24 0.00 -0.61 -3.12 0.00 0.00 179.24 175.70 3cdk h GLN 44 N 0.00 0.00 -0.66 3.56 4.15 -0.40 -3.48 115.11 118.29 3cdk h GLN 44 Ca -0.00 0.00 -0.28 0.00 0.77 0.00 0.00 58.65 59.13 3cdk h GLN 44 Cb 0.90 0.00 -0.11 0.00 0.21 0.00 0.00 27.48 28.48 3cdk h GLN 44 CO 0.03 0.00 -0.26 0.41 -1.93 0.00 0.00 178.83 177.08 3cdk n GLY 45 N 1.07 1.39 3.75 2.39 0.00 -0.95 -5.00 105.19 107.84 3cdk n GLY 45 Ca 0.04 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 3cdk n GLY 45 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3cdk n VAL 46 N -2.43 1.84 -4.31 1.61 3.14 -1.25 -5.00 118.33 111.93 3cdk n VAL 46 Ca -0.14 -0.46 -0.13 0.00 -2.96 0.00 0.00 64.34 60.65 3cdk n VAL 46 Cb 0.54 -1.85 -0.03 0.00 -1.06 0.00 0.00 33.84 31.44 3cdk n VAL 46 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 3cdk n LYS 47 N 0.73 1.49 -3.51 1.45 2.85 -1.26 -4.76 118.16 115.15 3cdk n LYS 47 Ca 0.03 -1.50 -0.26 0.00 -1.05 0.00 0.00 58.31 55.54 3cdk n LYS 47 Cb 0.38 0.41 -0.00 0.00 -0.65 0.00 0.00 35.03 35.16 3cdk n LYS 47 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3cdk n ASP 48 N -1.14 -3.92 -4.77 -5.58 8.00 -1.11 -0.70 116.55 107.33 3cdk n ASP 48 Ca -0.08 -0.50 -0.38 0.00 0.71 0.00 0.00 54.79 54.53 3cdk n ASP 48 Cb 0.26 -3.22 -0.06 0.00 -0.02 0.00 0.00 41.12 38.08 3cdk n ASP 48 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3cdk s LEU 49 N -6.68 4.43 -0.46 0.64 1.02 -0.36 -3.07 118.68 114.20 3cdk s LEU 49 Ca 0.47 1.93 -0.14 0.00 0.02 0.00 0.00 54.13 56.40 3cdk s LEU 49 Cb -0.24 -3.88 0.08 0.00 0.02 0.00 0.00 46.19 42.16 3cdk s LEU 49 CO 0.57 -0.05 0.37 -0.89 0.02 0.00 0.00 176.35 176.38 3cdk s THR 50 N -1.45 4.99 -0.15 5.49 2.01 0.15 0.43 115.64 127.11 3cdk s THR 50 Ca 0.48 -1.17 -0.08 0.00 0.31 0.00 0.00 61.69 61.23 3cdk s THR 50 Cb -0.22 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 3cdk s THR 50 CO 0.28 -0.58 0.13 0.68 -0.69 0.00 0.00 174.62 174.44 3cdk s VAL 51 N 1.59 5.41 -0.13 3.82 -7.23 0.36 -0.55 120.40 123.67 3cdk s VAL 51 Ca 0.04 0.18 0.02 0.00 -1.81 0.00 0.00 61.98 60.41 3cdk s VAL 51 Cb -0.24 -3.40 0.01 0.00 0.56 0.00 0.00 36.38 33.31 3cdk s VAL 51 CO 0.05 0.54 -0.19 0.54 -0.31 0.00 0.00 175.10 175.73 3cdk s VAL 52 N -0.43 1.82 -0.20 1.32 0.11 0.89 -0.89 120.40 123.02 3cdk s VAL 52 Ca 0.12 -0.84 -0.29 0.00 -2.93 0.00 0.00 61.98 58.04 3cdk s VAL 52 Cb -0.12 -1.63 0.14 0.00 -1.53 0.00 0.00 36.38 33.24 3cdk s VAL 52 CO 0.01 0.50 1.06 -0.55 -3.33 0.00 0.00 175.10 172.80 3cdk s SER 53 N 0.87 -0.34 0.21 3.54 0.15 -0.84 -0.21 113.70 117.08 3cdk s SER 53 Ca -0.07 0.44 -0.13 0.00 0.70 0.00 0.00 55.95 56.88 3cdk s SER 53 Cb -0.15 0.38 0.24 0.00 -1.71 0.00 0.00 66.02 64.77 3cdk s SER 53 CO -0.01 -0.26 1.63 -1.13 1.20 0.00 0.00 173.24 174.66 3cdk h ASN 54 N 2.84 -0.59 -2.55 5.45 -0.73 -1.79 -3.33 115.58 114.89 3cdk h ASN 54 Ca -0.19 0.19 -0.60 0.00 1.87 0.00 0.00 56.30 57.56 3cdk h ASN 54 Cb 1.17 0.39 -0.13 0.00 0.27 0.00 0.00 38.32 40.02 3cdk h ASN 54 CO 0.26 -0.21 -0.49 0.20 -0.37 0.00 0.00 177.43 176.82 3cdk s ASN 55 N -5.23 3.17 -0.55 1.15 -0.87 -1.26 -0.17 114.94 111.17 3cdk s ASN 55 Ca -0.14 -1.74 0.03 0.00 -1.57 0.00 0.00 52.86 49.44 3cdk s ASN 55 Cb 0.19 0.63 0.41 0.00 -0.02 0.00 0.00 41.25 42.47 3cdk s ASN 55 CO 0.74 -0.98 1.49 0.00 -2.57 0.00 0.00 177.10 175.77 3cdk n GLY 57 N -0.60 3.08 3.40 0.00 0.00 -1.26 -2.35 105.19 107.46 3cdk n GLY 57 Ca 0.47 -0.31 -0.20 0.00 0.00 0.00 0.00 46.02 45.99 3cdk n GLY 57 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3cdk s VAL 58 N 0.00 1.30 0.48 1.61 -7.23 -0.52 -4.70 120.40 111.34 3cdk s VAL 58 Ca 0.00 -2.06 0.22 0.00 -1.81 0.00 0.00 61.98 58.33 3cdk s VAL 58 Cb 0.00 -2.50 0.27 0.00 0.56 0.00 0.00 36.38 34.71 3cdk s VAL 58 CO 0.00 -0.23 2.09 -2.24 -0.31 0.00 0.00 175.10 174.41 3cdk h ASP 59 N 2.31 0.00 0.92 4.85 3.04 -1.84 -2.37 116.42 123.33 3cdk h ASP 59 Ca -0.40 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.39 3cdk h ASP 59 Cb 1.23 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.52 3cdk h ASP 59 CO 0.67 0.10 -0.37 -0.67 -2.04 0.00 0.00 179.24 176.94 3cdk n ASP 60 N -4.01 0.55 -3.48 4.15 4.64 -1.26 -4.42 116.55 112.72 3cdk n ASP 60 Ca -0.02 0.19 -0.11 0.00 -1.38 0.00 0.00 54.79 53.46 3cdk n ASP 60 Cb 0.19 -0.12 -0.03 0.00 -1.04 0.00 0.00 41.12 40.12 3cdk n ASP 60 CO 0.00 0.00 0.00 0.86 -0.82 0.00 0.00 177.20 177.24 3cdk s TRP 61 N -3.09 -0.45 0.00 -0.67 -0.00 -0.89 -4.90 118.94 108.94 3cdk s TRP 61 Ca 0.10 0.39 0.00 0.00 -0.00 0.00 0.00 56.10 56.59 3cdk s TRP 61 Cb 0.15 0.52 0.00 0.00 -0.00 0.00 0.00 33.47 34.14 3cdk s TRP 61 CO 0.66 -0.64 0.00 0.41 -0.00 0.00 0.00 176.95 177.37 3cdk n GLY 62 N -0.08 0.87 0.29 5.86 0.00 -1.26 -1.43 105.19 109.44 3cdk n GLY 62 Ca -0.13 -0.80 0.16 0.00 0.00 0.00 0.00 46.02 45.26 3cdk n GLY 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3cdk h LEU 63 N 0.00 0.00 -2.24 0.99 3.38 -1.87 -2.13 115.31 113.44 3cdk h LEU 63 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3cdk h LEU 63 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3cdk h LEU 63 CO 0.00 0.06 0.00 1.23 0.09 0.00 0.00 178.44 179.82 3cdk h GLY 64 N 0.76 0.00 1.85 0.83 0.00 -1.52 -0.84 103.07 104.16 3cdk h GLY 64 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 3cdk h GLY 64 CO 0.01 0.00 -0.52 1.41 0.00 0.00 0.00 176.54 177.44 3cdk h LEU 65 N 0.00 0.17 0.06 3.11 4.07 -1.57 -2.08 115.31 119.07 3cdk h LEU 65 Ca 0.00 -0.09 -0.25 0.00 0.08 0.00 0.00 57.88 57.62 3cdk h LEU 65 Cb 0.09 -0.05 0.02 0.00 1.08 0.00 0.00 40.66 41.80 3cdk h LEU 65 CO 0.00 0.66 -1.02 -0.07 -1.08 0.00 0.00 178.44 176.93 3cdk h LEU 66 N 0.12 0.79 0.27 1.67 3.38 -1.35 -2.75 115.31 117.44 3cdk h LEU 66 Ca 0.00 -0.79 -0.00 0.00 0.09 0.00 0.00 57.88 57.18 3cdk h LEU 66 Cb 0.96 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 3cdk h LEU 66 CO 0.08 1.49 -0.24 0.25 0.09 0.00 0.00 178.44 180.12 3cdk h LEU 67 N 0.18 -0.62 -1.64 1.67 5.85 -1.52 0.60 115.31 119.83 3cdk h LEU 67 Ca -0.14 0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.71 3cdk h LEU 67 Cb 1.71 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.91 3cdk h LEU 67 CO 0.20 -0.35 0.37 0.00 -0.34 0.00 0.00 178.44 178.31 3cdk h ALA 68 N 0.14 1.95 -0.02 1.25 0.00 -1.44 0.22 119.26 121.37 3cdk h ALA 68 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3cdk h ALA 68 Cb 0.47 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3cdk h ALA 68 CO -0.03 -0.06 0.00 -1.71 0.00 0.00 0.00 179.25 177.44 3cdk n ASN 69 N -4.47 0.95 -1.08 0.00 4.05 -0.95 -4.93 115.26 108.82 3cdk n ASN 69 Ca 0.08 -1.35 -0.07 0.00 0.45 0.00 0.00 54.58 53.69 3cdk n ASN 69 Cb 0.30 -0.01 0.01 0.00 1.23 0.00 0.00 39.78 41.31 3cdk n ASN 69 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 3cdk n LYS 70 N -0.25 -1.47 0.00 1.20 4.76 0.79 -4.95 118.16 118.25 3cdk n LYS 70 Ca 0.20 0.28 0.11 0.00 -2.87 0.00 0.00 58.31 56.03 3cdk n LYS 70 Cb 0.26 -3.84 -0.01 0.00 -1.84 0.00 0.00 35.03 29.60 3cdk n LYS 70 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3cdk n GLN 71 N -1.74 0.02 -3.51 1.97 6.02 0.02 -4.73 117.38 115.43 3cdk n GLN 71 Ca -0.04 -0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.56 3cdk n GLN 71 Cb 0.54 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 30.19 3cdk n GLN 71 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3cdk s ILE 72 N -3.02 5.26 0.04 5.09 1.01 -1.26 -1.22 121.20 127.10 3cdk s ILE 72 Ca 0.08 0.08 -0.15 0.00 0.00 0.00 0.00 60.65 60.66 3cdk s ILE 72 Cb 0.16 -3.66 -0.35 0.00 0.01 0.00 0.00 42.46 38.62 3cdk s ILE 72 CO 0.82 0.09 1.02 0.50 0.00 0.00 0.00 174.94 177.38 3cdk h LYS 73 N 8.40 0.55 -2.95 2.79 3.64 -0.26 -3.45 116.57 125.30 3cdk h LYS 73 Ca -0.32 -0.91 -0.14 0.00 -1.27 0.00 0.00 60.65 58.01 3cdk h LYS 73 Cb 1.17 0.33 -0.24 0.00 -0.41 0.00 0.00 32.23 33.07 3cdk h LYS 73 CO 0.61 1.43 -0.33 0.21 -2.27 0.00 0.00 179.45 179.11 3cdk s LYS 74 N -2.67 0.40 -0.13 1.90 2.20 -1.08 -3.58 119.74 116.78 3cdk s LYS 74 Ca -0.09 0.41 0.02 0.00 -0.36 0.00 0.00 55.97 55.95 3cdk s LYS 74 Cb 0.04 0.19 -0.00 0.00 -1.51 0.00 0.00 37.83 36.56 3cdk s LYS 74 CO 0.95 -0.05 -0.19 1.41 -0.36 0.00 0.00 175.35 177.10 3cdk s MET 75 N 0.08 3.14 -0.24 4.03 -2.45 -0.53 -0.49 119.30 122.84 3cdk s MET 75 Ca -0.01 -0.81 -0.04 0.00 -1.25 0.00 0.00 55.69 53.59 3cdk s MET 75 Cb -0.02 -2.48 0.00 0.00 1.25 0.00 0.00 34.83 33.58 3cdk s MET 75 CO 0.01 0.09 -0.03 0.42 1.05 0.00 0.00 175.02 176.56 3cdk s ILE 76 N 0.60 3.35 0.38 10.11 1.01 -0.07 -0.27 121.20 136.30 3cdk s ILE 76 Ca -0.11 -0.67 -0.13 0.00 0.00 0.00 0.00 60.65 59.74 3cdk s ILE 76 Cb -0.16 -2.61 0.05 0.00 0.01 0.00 0.00 42.46 39.75 3cdk s ILE 76 CO 0.03 0.30 0.73 0.00 0.00 0.00 0.00 174.94 176.00 3cdk n ALA 77 N 4.78 -1.56 -0.01 9.38 0.00 -1.08 -1.98 120.51 130.03 3cdk n ALA 77 Ca -0.17 -1.26 0.00 0.00 0.00 0.00 0.00 53.44 52.01 3cdk n ALA 77 Cb 0.49 1.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.93 3cdk n ALA 77 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3cdk n SER 78 N -1.52 4.53 -3.75 0.00 3.41 0.76 -0.75 113.62 116.29 3cdk n SER 78 Ca -0.08 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.38 3cdk n SER 78 Cb 0.57 0.81 -0.16 0.00 -0.26 0.00 0.00 64.21 65.17 3cdk n SER 78 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3cdk s TYR 79 N -2.09 0.03 -0.07 7.33 5.04 -0.95 -4.78 117.35 121.86 3cdk s TYR 79 Ca -0.01 0.16 -0.01 0.00 -2.44 0.00 0.00 57.07 54.77 3cdk s TYR 79 Cb 0.01 -0.28 -0.00 0.00 0.35 0.00 0.00 41.96 42.03 3cdk s TYR 79 CO 0.08 -0.11 -0.01 0.28 -1.34 0.00 0.00 175.55 174.45 3cdk h VAL 80 N 6.32 0.00 0.00 3.14 2.07 -1.96 -3.38 116.25 122.45 3cdk h VAL 80 Ca -0.40 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 66.40 3cdk h VAL 80 Cb 1.12 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 3cdk h VAL 80 CO 0.42 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.62 3cdk n GLY 81 N 1.83 1.53 2.35 2.17 0.00 -1.26 -3.46 105.19 108.34 3cdk n GLY 81 Ca -0.00 -0.48 -0.26 0.00 0.00 0.00 0.00 46.02 45.28 3cdk n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cdk n GLU 82 N 12.75 2.77 -3.94 1.61 -0.58 -1.26 -4.73 120.64 127.26 3cdk n GLU 82 Ca 0.00 -2.17 -0.30 0.00 -0.42 0.00 0.00 57.16 54.26 3cdk n GLU 82 Cb 0.00 -2.24 -0.15 0.00 -0.57 0.00 0.00 31.44 28.47 3cdk n GLU 82 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 3cdk s ASN 83 N 0.93 3.93 0.36 1.62 3.84 -1.23 -4.44 114.94 119.95 3cdk s ASN 83 Ca 0.61 -1.27 0.23 0.00 0.21 0.00 0.00 52.86 52.64 3cdk s ASN 83 Cb 0.32 -1.20 0.22 0.00 -0.55 0.00 0.00 41.25 40.05 3cdk s ASN 83 CO -0.13 -0.25 1.42 0.11 -2.79 0.00 0.00 177.10 175.46 3cdk h LYS 84 N 7.94 0.00 0.02 0.43 6.56 -1.94 -1.29 116.57 128.30 3cdk h LYS 84 Ca -0.17 0.00 -0.11 0.00 -1.06 0.00 0.00 60.65 59.31 3cdk h LYS 84 Cb 1.06 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.73 3cdk h LYS 84 CO 0.42 0.01 -0.44 0.82 -2.06 0.00 0.00 179.45 178.21 3cdk h ILE 85 N 0.00 1.53 0.25 1.86 2.04 -1.97 -2.77 117.51 118.44 3cdk h ILE 85 Ca -0.00 -2.13 0.01 0.00 1.00 0.00 0.00 64.86 63.74 3cdk h ILE 85 Cb 1.01 2.85 -0.03 0.00 -0.74 0.00 0.00 36.82 39.91 3cdk h ILE 85 CO 0.00 0.59 -0.36 0.15 0.00 0.00 0.00 178.15 178.54 3cdk h PHE 86 N -0.40 -0.99 -0.49 1.37 3.04 -1.96 -1.95 116.94 115.57 3cdk h PHE 86 Ca -0.06 0.01 0.08 0.00 3.98 0.00 0.00 57.97 61.98 3cdk h PHE 86 Cb 1.21 0.40 -0.07 0.00 2.56 0.00 0.00 35.95 40.06 3cdk h PHE 86 CO 0.18 -0.49 0.12 1.49 -2.02 0.00 0.00 178.31 177.59 3cdk h GLU 87 N -0.68 0.26 -0.07 1.11 4.81 -1.33 0.19 114.58 118.87 3cdk h GLU 87 Ca -0.00 -0.02 -0.24 0.00 -0.13 0.00 0.00 59.36 58.97 3cdk h GLU 87 Cb 0.65 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.99 3cdk h GLU 87 CO -0.13 0.17 -0.92 0.00 -0.73 0.00 0.00 179.01 177.40 3cdk h ARG 88 N 0.27 0.71 -0.54 1.92 -0.00 -1.49 -0.63 114.38 114.62 3cdk h ARG 88 Ca 0.24 -0.68 -0.10 0.00 -0.50 0.00 0.00 59.98 58.95 3cdk h ARG 88 Cb 0.31 0.17 -0.02 0.00 0.00 0.00 0.00 29.97 30.43 3cdk h ARG 88 CO -0.30 1.27 -0.05 0.37 0.00 0.00 0.00 179.97 181.26 3cdk h GLN 89 N 0.44 0.96 0.02 0.04 4.15 -1.08 -1.17 115.11 118.47 3cdk h GLN 89 Ca -0.09 -0.31 0.01 0.00 0.77 0.00 0.00 58.65 59.02 3cdk h GLN 89 Cb 1.56 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 29.14 3cdk h GLN 89 CO 0.18 0.97 -0.26 0.35 -1.93 0.00 0.00 178.83 178.15 3cdk h PHE 90 N 0.87 -0.76 -1.11 3.99 3.57 -0.52 -1.26 116.94 121.73 3cdk h PHE 90 Ca 0.15 0.02 0.31 0.00 3.53 0.00 0.00 57.97 61.98 3cdk h PHE 90 Cb 0.58 0.33 -0.07 0.00 2.79 0.00 0.00 35.95 39.57 3cdk h PHE 90 CO 0.04 -0.28 0.75 -0.07 -2.23 0.00 0.00 178.31 176.51 3cdk h LEU 91 N -0.34 0.24 -0.12 0.59 -0.00 -0.93 -1.19 115.31 113.56 3cdk h LEU 91 Ca 0.00 0.05 -0.11 0.00 -0.00 0.00 0.00 57.88 57.83 3cdk h LEU 91 Cb 0.36 0.01 -0.02 0.00 -0.00 0.00 0.00 40.66 41.01 3cdk h LEU 91 CO -0.16 0.03 -0.50 -1.28 -0.00 0.00 0.00 178.44 176.53 3cdk h SER 92 N 0.20 0.00 0.00 -0.43 0.87 -1.00 -3.47 113.55 109.72 3cdk h SER 92 Ca 0.59 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.15 3cdk h SER 92 Cb 1.87 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.83 3cdk h SER 92 CO -0.17 0.50 0.00 0.61 -0.53 0.00 0.00 176.83 177.24 3cdk n GLY 93 N 1.11 0.86 0.13 5.77 0.00 -0.45 -4.95 105.19 107.66 3cdk n GLY 93 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 3cdk n GLY 93 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3cdk h GLU 94 N 2.81 0.33 -4.99 1.61 4.81 -1.48 -3.38 114.58 114.29 3cdk h GLU 94 Ca 0.00 -0.08 -0.64 0.00 -0.13 0.00 0.00 59.36 58.51 3cdk h GLU 94 Cb 0.00 -0.04 -0.16 0.00 0.63 0.00 0.00 28.75 29.17 3cdk h GLU 94 CO 0.00 0.45 -0.38 -1.17 -0.73 0.00 0.00 179.01 177.17 3cdk s LEU 95 N -9.69 4.12 -0.08 1.64 2.96 -1.08 -5.04 118.68 111.50 3cdk s LEU 95 Ca -0.14 0.04 -0.29 0.00 -0.22 0.00 0.00 54.13 53.52 3cdk s LEU 95 Cb 0.07 -2.26 -0.07 0.00 0.50 0.00 0.00 46.19 44.43 3cdk s LEU 95 CO 0.72 -0.15 1.96 -0.70 -1.32 0.00 0.00 176.35 176.86 3cdk s GLU 96 N 1.90 3.80 -0.08 1.98 2.12 -1.23 -4.48 118.70 122.71 3cdk s GLU 96 Ca 0.10 2.27 0.03 0.00 0.36 0.00 0.00 54.97 57.73 3cdk s GLU 96 Cb -0.16 -4.19 0.01 0.00 0.26 0.00 0.00 34.13 30.05 3cdk s GLU 96 CO 0.11 -1.33 -0.16 0.08 -0.54 0.00 0.00 175.26 173.42 3cdk s VAL 97 N 5.65 1.44 -0.40 3.70 1.01 -1.26 -1.45 120.40 129.08 3cdk s VAL 97 Ca 0.88 -0.65 -0.10 0.00 0.00 0.00 0.00 61.98 62.11 3cdk s VAL 97 Cb -0.37 -1.28 0.06 0.00 0.00 0.00 0.00 36.38 34.79 3cdk s VAL 97 CO 0.37 0.42 0.24 -0.70 0.00 0.00 0.00 175.10 175.43 3cdk s GLU 98 N 0.59 2.67 -0.18 2.72 2.12 0.62 -4.97 118.70 122.27 3cdk s GLU 98 Ca -0.15 -1.34 -0.22 0.00 0.36 0.00 0.00 54.97 53.62 3cdk s GLU 98 Cb -0.16 -3.75 -0.03 0.00 0.26 0.00 0.00 34.13 30.45 3cdk s GLU 98 CO 0.05 -0.87 0.66 -1.17 -0.54 0.00 0.00 175.26 173.39 3cdk s LEU 99 N 1.46 4.17 -0.07 2.70 2.96 -1.26 -2.65 118.68 125.99 3cdk s LEU 99 Ca 0.02 0.91 0.02 0.00 -0.22 0.00 0.00 54.13 54.87 3cdk s LEU 99 Cb -0.22 -2.95 0.01 0.00 0.50 0.00 0.00 46.19 43.54 3cdk s LEU 99 CO 0.03 -0.27 -0.12 -0.69 -1.32 0.00 0.00 176.35 173.98 3cdk s VAL 100 N 1.80 1.15 0.59 1.68 1.01 0.07 -4.99 120.40 121.72 3cdk s VAL 100 Ca 0.31 -0.49 -0.19 0.00 0.00 0.00 0.00 61.98 61.61 3cdk s VAL 100 Cb -0.16 -1.05 -0.05 0.00 0.00 0.00 0.00 36.38 35.12 3cdk s VAL 100 CO 0.11 0.36 1.01 -2.65 0.00 0.00 0.00 175.10 173.93 3cdk n PRO 101 N 3.81 0.99 -0.17 2.72 -0.02 -1.26 -3.87 135.00 137.20 3cdk n PRO 101 Ca -0.23 0.38 -0.09 0.00 -2.02 0.00 0.00 63.50 61.55 3cdk n PRO 101 Cb 0.52 -2.20 0.01 0.00 -0.02 0.00 0.00 33.50 31.80 3cdk n PRO 101 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3cdk h GLN 102 N 0.62 0.74 -0.84 -0.52 4.15 -1.94 0.13 115.11 117.46 3cdk h GLN 102 Ca -0.48 -0.16 0.05 0.00 0.77 0.00 0.00 58.65 58.83 3cdk h GLN 102 Cb 1.36 -0.11 -0.06 0.00 0.21 0.00 0.00 27.48 28.88 3cdk h GLN 102 CO 0.52 0.70 0.52 0.78 -1.93 0.00 0.00 178.83 179.41 3cdk h GLY 103 N 0.64 1.25 1.81 2.39 0.00 -2.00 -0.43 103.07 106.73 3cdk h GLY 103 Ca 0.16 -0.38 -0.16 0.00 0.00 0.00 0.00 47.33 46.94 3cdk h GLY 103 CO -0.01 0.28 -0.70 -0.84 0.00 0.00 0.00 176.54 175.27 3cdk h THR 104 N 0.97 1.44 0.23 4.70 2.02 -1.71 -2.32 112.91 118.23 3cdk h THR 104 Ca 0.36 -2.24 -0.01 0.00 0.77 0.00 0.00 66.41 65.29 3cdk h THR 104 Cb 0.13 2.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.73 3cdk h THR 104 CO -0.16 0.65 -0.11 0.25 0.37 0.00 0.00 175.52 176.53 3cdk h LEU 105 N 0.13 -0.26 -0.53 2.58 5.85 0.05 0.27 115.31 123.39 3cdk h LEU 105 Ca -0.02 -0.25 0.11 0.00 0.84 0.00 0.00 57.88 58.56 3cdk h LEU 105 Cb 1.25 0.07 -0.10 0.00 0.37 0.00 0.00 40.66 42.24 3cdk h LEU 105 CO 0.11 0.16 -0.15 0.00 -0.34 0.00 0.00 178.44 178.21 3cdk h ALA 106 N -0.12 0.31 -0.11 1.25 0.00 -1.13 -1.35 119.26 118.11 3cdk h ALA 106 Ca -0.03 0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.94 3cdk h ALA 106 Cb 0.49 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 3cdk h ALA 106 CO 0.05 -0.46 -0.56 1.49 0.00 0.00 0.00 179.25 179.77 3cdk h GLU 107 N -0.02 0.33 -0.29 0.00 4.57 -1.36 0.70 114.58 118.50 3cdk h GLU 107 Ca 0.25 -0.21 -0.02 0.00 -1.18 0.00 0.00 59.36 58.21 3cdk h GLU 107 Cb 0.41 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 3cdk h GLU 107 CO -0.56 0.80 0.12 0.00 -1.18 0.00 0.00 179.01 178.19 3cdk h ARG 108 N 0.25 0.44 -0.39 1.92 3.08 -0.26 0.11 114.38 119.52 3cdk h ARG 108 Ca 0.00 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 3cdk h ARG 108 Cb 1.06 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.02 3cdk h ARG 108 CO 0.09 0.46 0.15 0.82 -1.07 0.00 0.00 179.97 180.42 3cdk h ILE 109 N 0.33 1.20 -0.71 2.04 2.04 -1.09 -0.77 117.51 120.54 3cdk h ILE 109 Ca 0.10 -0.61 0.01 0.00 1.00 0.00 0.00 64.86 65.36 3cdk h ILE 109 Cb 0.18 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 3cdk h ILE 109 CO -0.01 0.22 0.47 -0.09 0.00 0.00 0.00 178.15 178.74 3cdk h ARG 110 N 0.49 0.90 -0.60 2.37 2.43 -0.54 -2.24 114.38 117.20 3cdk h ARG 110 Ca 0.13 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.15 3cdk h ARG 110 Cb 0.20 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 3cdk h ARG 110 CO -0.01 0.60 -0.02 0.00 -1.51 0.00 0.00 179.97 179.03 3cdk h ALA 111 N 1.57 0.81 -0.27 2.80 0.00 -0.29 0.80 119.26 124.68 3cdk h ALA 111 Ca 0.26 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.90 3cdk h ALA 111 Cb -0.07 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3cdk h ALA 111 CO -0.06 0.66 0.02 0.78 0.00 0.00 0.00 179.25 180.65 3cdk h GLY 112 N 0.96 0.28 2.00 0.00 0.00 -0.73 0.18 103.07 105.76 3cdk h GLY 112 Ca 0.17 0.02 -0.08 0.00 0.00 0.00 0.00 47.33 47.43 3cdk h GLY 112 CO 0.03 -0.04 -0.39 -1.33 0.00 0.00 0.00 176.54 174.81 3cdk h GLY 113 N 0.10 0.00 -1.53 4.60 0.00 -1.08 -2.98 103.07 102.18 3cdk h GLY 113 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3cdk h GLY 113 CO -0.20 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.34 3cdk n ALA 114 N -2.29 2.47 -0.96 3.60 0.00 0.24 -4.85 120.51 118.72 3cdk n ALA 114 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.69 3cdk n ALA 114 Cb 0.54 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.00 3cdk n ALA 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cdk n GLY 115 N 1.30 0.58 3.60 0.00 0.00 -0.23 -5.01 105.19 105.43 3cdk n GLY 115 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 3cdk n GLY 115 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cdk s ILE 116 N -2.50 3.98 -0.61 -0.61 -1.09 0.48 -4.91 121.20 115.94 3cdk s ILE 116 Ca 0.00 1.02 0.26 0.00 -2.23 0.00 0.00 60.65 59.70 3cdk s ILE 116 Cb 0.00 -4.26 0.30 0.00 -1.58 0.00 0.00 42.46 36.91 3cdk s ILE 116 CO 0.00 -0.76 1.75 1.55 -1.23 0.00 0.00 174.94 176.24 3cdk h PRO 117 N 10.27 0.00 -1.72 2.79 0.13 -1.95 -3.32 132.00 138.19 3cdk h PRO 117 Ca -0.27 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.89 3cdk h PRO 117 Cb 1.10 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.00 3cdk h PRO 117 CO 1.09 0.00 0.39 0.20 -0.23 0.00 0.00 178.00 179.44 3cdk s GLY 118 N -3.72 -0.34 0.03 1.56 0.00 -1.26 -1.22 107.32 102.37 3cdk s GLY 118 Ca 0.09 2.07 -0.28 0.00 0.00 0.00 0.00 44.72 46.60 3cdk s GLY 118 CO 0.58 1.35 0.67 -0.11 0.00 0.00 0.00 173.10 175.59 3cdk s PHE 119 N -0.53 -0.59 0.03 1.90 -0.71 -0.38 -4.94 117.98 112.75 3cdk s PHE 119 Ca -0.02 0.78 0.01 0.00 -1.04 0.00 0.00 56.93 56.66 3cdk s PHE 119 Cb -0.02 0.47 -0.04 0.00 -1.21 0.00 0.00 43.02 42.22 3cdk s PHE 119 CO 0.01 -0.69 0.06 0.71 -1.34 0.00 0.00 175.22 173.97 3cdk s TYR 120 N -2.22 3.19 0.06 3.49 2.02 -1.26 -0.55 117.35 122.08 3cdk s TYR 120 Ca -0.06 0.12 -0.16 0.00 -0.37 0.00 0.00 57.07 56.61 3cdk s TYR 120 Cb -0.00 -1.68 0.03 0.00 -0.40 0.00 0.00 41.96 39.91 3cdk s TYR 120 CO 0.00 0.52 0.37 -0.08 -1.57 0.00 0.00 175.55 174.79 3cdk s THR 121 N -1.23 0.07 -0.46 -0.71 -1.32 -0.98 -4.95 115.64 106.05 3cdk s THR 121 Ca 0.24 -0.56 0.24 0.00 -1.21 0.00 0.00 61.69 60.39 3cdk s THR 121 Cb -0.12 -0.99 0.11 0.00 -1.51 0.00 0.00 72.50 69.99 3cdk s THR 121 CO 0.16 -0.31 1.32 0.00 -2.21 0.00 0.00 174.62 173.58 3cdk h ALA 122 N 2.97 0.68 -1.66 11.08 0.00 -1.88 -0.13 119.26 130.31 3cdk h ALA 122 Ca -0.32 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 53.95 3cdk h ALA 122 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3cdk h ALA 122 CO 0.45 0.00 1.28 2.41 0.00 0.00 0.00 179.25 183.40 3cdk n THR 123 N -2.54 0.38 -0.35 0.00 -1.04 -1.26 -2.46 114.28 107.01 3cdk n THR 123 Ca 0.02 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 3cdk n THR 123 Cb 0.50 -1.90 0.00 0.00 -1.82 0.00 0.00 70.33 67.11 3cdk n THR 123 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3cdk n GLY 124 N 5.44 0.70 3.76 3.41 0.00 -1.26 -4.92 105.19 112.32 3cdk n GLY 124 Ca 0.31 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.96 3cdk n GLY 124 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3cdk s VAL 125 N -2.59 2.63 0.00 1.61 -7.23 -1.03 -2.14 120.40 111.65 3cdk s VAL 125 Ca 0.00 0.46 0.00 0.00 -1.81 0.00 0.00 61.98 60.63 3cdk s VAL 125 Cb 0.00 -3.22 0.00 0.00 0.56 0.00 0.00 36.38 33.72 3cdk s VAL 125 CO 0.00 -0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.38 3cdk n GLY 126 N 0.56 1.22 3.66 2.32 0.00 -1.26 -5.00 105.19 106.68 3cdk n GLY 126 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 3cdk n GLY 126 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cdk s THR 127 N -3.86 2.32 0.50 2.61 -4.23 -0.91 -5.03 115.64 107.05 3cdk s THR 127 Ca 0.00 -1.90 0.41 0.00 -1.18 0.00 0.00 61.69 59.03 3cdk s THR 127 Cb 0.00 -2.91 0.42 0.00 1.34 0.00 0.00 72.50 71.35 3cdk s THR 127 CO 0.00 -0.08 2.26 0.77 -0.54 0.00 0.00 174.62 177.03 3cdk h SER 128 N 1.68 0.00 -0.03 3.99 4.64 -1.95 -2.46 113.55 119.42 3cdk h SER 128 Ca -0.43 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.84 3cdk h SER 128 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 3cdk h SER 128 CO 0.72 0.00 -0.09 0.40 -0.87 0.00 0.00 176.83 176.99 3cdk h ILE 129 N 0.00 1.17 -0.01 0.95 5.03 -1.96 -2.85 117.51 119.84 3cdk h ILE 129 Ca 0.00 -0.74 0.00 0.00 -0.12 0.00 0.00 64.86 64.00 3cdk h ILE 129 Cb 0.08 1.14 0.00 0.00 -3.03 0.00 0.00 36.82 35.01 3cdk h ILE 129 CO 0.00 0.24 -0.21 0.00 -0.68 0.00 0.00 178.15 177.49 3cdk n ALA 130 N -2.49 2.98 -1.83 1.87 0.00 -0.93 -4.90 120.51 115.21 3cdk n ALA 130 Ca -0.00 -0.38 -0.41 0.00 0.00 0.00 0.00 53.44 52.64 3cdk n ALA 130 Cb 0.25 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 18.51 3cdk n ALA 130 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3cdk s GLU 131 N -2.46 4.22 0.00 0.00 2.02 -1.08 -3.00 118.70 118.41 3cdk s GLU 131 Ca 0.26 2.39 0.00 0.00 0.02 0.00 0.00 54.97 57.64 3cdk s GLU 131 Cb 0.19 -3.08 0.00 0.00 0.10 0.00 0.00 34.13 31.35 3cdk s GLU 131 CO 0.50 -0.48 0.00 0.41 0.02 0.00 0.00 175.26 175.71 3cdk n GLY 132 N 2.08 0.72 3.45 -1.39 0.00 -1.26 -5.07 105.19 103.73 3cdk n GLY 132 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 3cdk n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cdk s LYS 133 N -0.22 1.61 0.30 1.61 1.02 -1.16 -5.11 119.74 117.79 3cdk s LYS 133 Ca 0.00 -1.41 -0.30 0.00 0.02 0.00 0.00 55.97 54.28 3cdk s LYS 133 Cb 0.00 -1.94 -0.12 0.00 -0.52 0.00 0.00 37.83 35.25 3cdk s LYS 133 CO 0.00 0.42 1.49 0.39 -0.92 0.00 0.00 175.35 176.74 3cdk n GLU 134 N 0.42 2.44 -4.82 1.68 4.71 -1.26 -4.85 120.64 118.96 3cdk n GLU 134 Ca -0.14 0.86 -0.33 0.00 -0.01 0.00 0.00 57.16 57.55 3cdk n GLU 134 Cb 0.55 -2.58 -0.13 0.00 -1.01 0.00 0.00 31.44 28.27 3cdk n GLU 134 CO 0.00 0.00 0.00 -1.01 0.09 0.00 0.00 177.13 176.21 3cdk s HIS 135 N -0.30 2.77 -0.05 -0.32 3.76 -1.26 -1.20 115.29 118.69 3cdk s HIS 135 Ca 0.63 -0.15 -0.04 0.00 -0.15 0.00 0.00 55.06 55.34 3cdk s HIS 135 Cb -0.54 -1.67 0.01 0.00 1.11 0.00 0.00 32.58 31.49 3cdk s HIS 135 CO 0.53 0.19 0.13 0.21 -0.85 0.00 0.00 174.74 174.94 3cdk s LYS 136 N -0.66 0.15 -0.06 1.40 2.20 -0.43 -4.97 119.74 117.36 3cdk s LYS 136 Ca 0.10 0.18 -0.14 0.00 -0.36 0.00 0.00 55.97 55.75 3cdk s LYS 136 Cb -0.11 0.07 -0.05 0.00 -1.51 0.00 0.00 37.83 36.22 3cdk s LYS 136 CO 0.01 -0.02 0.37 0.95 -0.36 0.00 0.00 175.35 176.30 3cdk s THR 137 N 0.09 5.15 0.02 3.43 -4.23 -1.26 -0.33 115.64 118.51 3cdk s THR 137 Ca -0.00 0.74 0.08 0.00 -1.18 0.00 0.00 61.69 61.33 3cdk s THR 137 Cb -0.01 -3.68 -0.02 0.00 1.34 0.00 0.00 72.50 70.12 3cdk s THR 137 CO 0.00 0.51 -0.25 -0.36 -0.54 0.00 0.00 174.62 173.98 3cdk s PHE 138 N -0.55 2.22 -0.43 3.99 0.40 -0.51 -4.84 117.98 118.28 3cdk s PHE 138 Ca 0.22 -0.41 0.00 0.00 -0.60 0.00 0.00 56.93 56.14 3cdk s PHE 138 Cb -0.15 -1.38 0.00 0.00 0.51 0.00 0.00 43.02 42.00 3cdk s PHE 138 CO 0.10 0.05 0.00 0.41 0.70 0.00 0.00 175.22 176.48 3cdk n GLY 139 N 2.10 -0.02 0.50 4.36 0.00 -1.26 -0.64 105.19 110.23 3cdk n GLY 139 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3cdk n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cdk n GLY 140 N -0.34 3.40 3.92 -0.02 0.00 -1.26 -5.06 105.19 105.83 3cdk n GLY 140 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 3cdk n GLY 140 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cdk s ARG 141 N -0.82 3.43 -0.10 1.61 0.52 0.19 -5.03 118.95 118.76 3cdk s ARG 141 Ca 0.00 -0.43 -0.16 0.00 -0.52 0.00 0.00 55.73 54.62 3cdk s ARG 141 Cb 0.00 -3.04 -0.05 0.00 0.52 0.00 0.00 34.95 32.38 3cdk s ARG 141 CO 0.00 0.62 0.40 0.99 0.02 0.00 0.00 175.30 177.32 3cdk s THR 142 N -1.49 5.18 0.17 0.02 2.01 -1.26 -1.42 115.64 118.86 3cdk s THR 142 Ca 0.34 0.79 0.08 0.00 0.31 0.00 0.00 61.69 63.21 3cdk s THR 142 Cb -0.13 -3.73 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 3cdk s THR 142 CO 0.27 0.42 -0.17 -0.31 -0.69 0.00 0.00 174.62 174.14 3cdk s TYR 143 N 0.08 1.76 -0.09 4.92 1.51 0.56 -4.68 117.35 121.40 3cdk s TYR 143 Ca 0.22 -0.50 -0.03 0.00 -1.01 0.00 0.00 57.07 55.76 3cdk s TYR 143 Cb -0.15 -0.86 -0.03 0.00 -0.11 0.00 0.00 41.96 40.80 3cdk s TYR 143 CO 0.09 0.33 0.02 0.08 -1.11 0.00 0.00 175.55 174.96 3cdk s VAL 144 N -2.29 4.48 -0.08 0.71 1.01 -0.06 -1.32 120.40 122.86 3cdk s VAL 144 Ca 0.17 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.67 3cdk s VAL 144 Cb -0.04 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.40 3cdk s VAL 144 CO 0.06 0.61 1.34 -0.22 0.00 0.00 0.00 175.10 176.89 3cdk s LEU 145 N -0.89 4.26 -0.04 3.92 2.96 -0.34 -2.33 118.68 126.23 3cdk s LEU 145 Ca 0.13 1.92 0.03 0.00 -0.22 0.00 0.00 54.13 55.99 3cdk s LEU 145 Cb -0.11 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.00 3cdk s LEU 145 CO 0.03 -0.73 -0.09 -1.61 -1.32 0.00 0.00 176.35 172.63 3cdk s GLU 146 N 2.94 2.59 -0.10 1.98 0.41 0.28 -4.66 118.70 122.15 3cdk s GLU 146 Ca 0.60 -0.66 -0.12 0.00 -0.41 0.00 0.00 54.97 54.38 3cdk s GLU 146 Cb -0.27 -2.49 -0.05 0.00 -1.78 0.00 0.00 34.13 29.54 3cdk s GLU 146 CO 0.22 0.63 0.28 1.03 -0.49 0.00 0.00 175.26 176.93 3cdk s ARG 147 N -1.01 3.92 0.22 1.61 0.52 -1.26 -1.25 118.95 121.70 3cdk s ARG 147 Ca 0.14 0.12 -0.31 0.00 -0.52 0.00 0.00 55.73 55.16 3cdk s ARG 147 Cb -0.11 -3.30 -0.15 0.00 0.52 0.00 0.00 34.95 31.91 3cdk s ARG 147 CO 0.03 0.53 1.10 0.41 0.02 0.00 0.00 175.30 177.39 3cdk n GLY 148 N 2.53 -0.08 3.61 -3.53 0.00 -0.36 -4.78 105.19 102.58 3cdk n GLY 148 Ca -0.15 0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.97 3cdk n GLY 148 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cdk s ILE 149 N -0.54 4.07 -0.02 -0.61 1.01 -0.39 -4.76 121.20 119.96 3cdk s ILE 149 Ca 0.67 -0.33 0.02 0.00 0.00 0.00 0.00 60.65 61.01 3cdk s ILE 149 Cb -0.78 -2.72 0.00 0.00 0.01 0.00 0.00 42.46 38.97 3cdk s ILE 149 CO 0.55 0.57 -0.07 -0.89 0.00 0.00 0.00 174.94 175.10 3cdk s THR 150 N -0.50 0.66 0.31 2.92 2.01 -1.26 -3.85 115.64 115.92 3cdk s THR 150 Ca 0.08 -0.29 0.09 0.00 0.31 0.00 0.00 61.69 61.88 3cdk s THR 150 Cb -0.12 -0.59 -0.05 0.00 0.01 0.00 0.00 72.50 71.75 3cdk s THR 150 CO 0.02 0.21 0.00 -0.83 -0.69 0.00 0.00 174.62 173.33 3cdk s GLY 151 N 0.22 1.87 0.26 4.40 0.00 -0.93 -4.93 107.32 108.21 3cdk s GLY 151 Ca -0.03 -1.82 0.06 0.00 0.00 0.00 0.00 44.72 42.93 3cdk s GLY 151 CO 0.00 -1.82 1.60 -0.55 0.00 0.00 0.00 173.10 172.33 3cdk h ASP 152 N 1.85 0.22 -3.72 1.64 3.32 -1.16 -1.58 116.42 116.98 3cdk h ASP 152 Ca -0.43 -0.12 -0.18 0.00 0.02 0.00 0.00 57.03 56.32 3cdk h ASP 152 Cb 1.25 -0.06 -0.27 0.00 0.22 0.00 0.00 39.33 40.47 3cdk h ASP 152 CO 0.63 0.74 -0.47 -0.69 -1.72 0.00 0.00 179.24 177.73 3cdk s VAL 153 N -3.83 -0.01 -0.04 -1.35 1.01 -1.04 -2.03 120.40 113.12 3cdk s VAL 153 Ca -0.04 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.03 3cdk s VAL 153 Cb 0.12 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 36.16 3cdk s VAL 153 CO 0.79 0.01 -0.19 0.00 0.00 0.00 0.00 175.10 175.71 3cdk s ALA 154 N 0.34 2.48 -0.22 5.51 0.00 0.10 -0.78 121.76 129.18 3cdk s ALA 154 Ca -0.02 -1.03 -0.02 0.00 0.00 0.00 0.00 51.96 50.89 3cdk s ALA 154 Cb -0.03 -0.81 0.07 0.00 0.00 0.00 0.00 23.12 22.34 3cdk s ALA 154 CO -0.01 0.54 0.04 -1.50 0.00 0.00 0.00 175.76 174.83 3cdk s ILE 155 N -0.67 0.62 0.22 0.00 1.10 -0.24 -0.76 121.20 121.47 3cdk s ILE 155 Ca 0.11 -0.75 0.06 0.00 -0.51 0.00 0.00 60.65 59.56 3cdk s ILE 155 Cb -0.10 -1.19 -0.05 0.00 0.15 0.00 0.00 42.46 41.27 3cdk s ILE 155 CO 0.00 -0.30 -0.09 0.68 -2.11 0.00 0.00 174.94 173.12 3cdk s VAL 156 N 1.80 1.50 -0.08 4.00 -7.23 -0.81 -2.04 120.40 117.53 3cdk s VAL 156 Ca 0.01 -2.13 0.03 0.00 -1.81 0.00 0.00 61.98 58.07 3cdk s VAL 156 Cb -0.17 -2.16 0.01 0.00 0.56 0.00 0.00 36.38 34.61 3cdk s VAL 156 CO -0.12 -0.50 -0.17 -0.75 -0.31 0.00 0.00 175.10 173.25 3cdk s LYS 157 N -3.72 2.24 0.25 4.82 2.47 -1.26 -0.35 119.74 124.19 3cdk s LYS 157 Ca 0.24 -0.59 0.05 0.00 -1.56 0.00 0.00 55.97 54.11 3cdk s LYS 157 Cb 0.02 -1.78 -0.05 0.00 -1.46 0.00 0.00 37.83 34.55 3cdk s LYS 157 CO 0.07 0.06 -0.03 0.00 0.16 0.00 0.00 175.35 175.62 3cdk s ALA 158 N 0.61 2.03 -0.15 3.13 0.00 0.11 -4.88 121.76 122.62 3cdk s ALA 158 Ca -0.15 -1.82 -0.23 0.00 0.00 0.00 0.00 51.96 49.76 3cdk s ALA 158 Cb -0.16 0.37 -0.20 0.00 0.00 0.00 0.00 23.12 23.12 3cdk s ALA 158 CO 0.05 -0.18 0.49 2.35 0.00 0.00 0.00 175.76 178.47 3cdk h TRP 159 N 2.39 0.00 -4.12 0.00 7.01 -1.44 -2.58 115.95 117.21 3cdk h TRP 159 Ca -0.39 0.00 -0.47 0.00 2.11 0.00 0.00 58.89 60.14 3cdk h TRP 159 Cb 1.23 0.00 -0.27 0.00 -2.10 0.00 0.00 29.16 28.02 3cdk h TRP 159 CO 0.62 0.94 -0.81 0.15 -2.79 0.00 0.00 178.44 176.56 3cdk s LYS 160 N -2.17 1.06 0.08 2.65 1.02 -0.94 -0.98 119.74 120.46 3cdk s LYS 160 Ca -0.19 -0.67 0.03 0.00 0.02 0.00 0.00 55.97 55.17 3cdk s LYS 160 Cb -0.00 -1.06 -0.03 0.00 -0.52 0.00 0.00 37.83 36.22 3cdk s LYS 160 CO 0.55 0.27 -0.10 0.00 -0.92 0.00 0.00 175.35 175.16 3cdk s ALA 161 N -0.63 0.96 0.40 5.17 0.00 0.07 -1.66 121.76 126.07 3cdk s ALA 161 Ca 0.04 -1.07 0.08 0.00 0.00 0.00 0.00 51.96 51.01 3cdk s ALA 161 Cb -0.07 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 3cdk s ALA 161 CO 0.01 -0.03 0.36 0.16 0.00 0.00 0.00 175.76 176.26 3cdk s ASP 162 N -2.18 5.11 0.25 0.00 1.47 -0.72 -0.47 116.67 120.13 3cdk s ASP 162 Ca 0.01 -0.69 0.11 0.00 1.18 0.00 0.00 52.55 53.16 3cdk s ASP 162 Cb -0.05 -0.66 0.61 0.00 -0.34 0.00 0.00 42.92 42.48 3cdk s ASP 162 CO -0.00 -0.59 1.23 0.35 0.68 0.00 0.00 175.17 176.84 3cdk n THR 163 N -1.51 0.82 0.10 2.11 -2.24 -0.60 -1.09 114.28 111.87 3cdk n THR 163 Ca 0.02 0.69 0.04 0.00 -2.27 0.00 0.00 64.05 62.54 3cdk n THR 163 Cb 0.61 -1.69 0.08 0.00 -2.10 0.00 0.00 70.33 67.24 3cdk n THR 163 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 3cdk n MET 164 N -1.91 1.65 -0.24 -0.78 0.00 -1.26 -1.46 117.12 113.12 3cdk n MET 164 Ca -0.01 -1.51 0.00 0.00 0.00 0.00 0.00 57.70 56.18 3cdk n MET 164 Cb 0.25 -1.19 0.00 0.00 0.00 0.00 0.00 33.22 32.28 3cdk n MET 164 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3cdk n GLY 165 N 0.39 0.76 3.76 -5.12 0.00 -0.25 -4.40 105.19 100.33 3cdk n GLY 165 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3cdk n GLY 165 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3cdk s ASN 166 N -2.90 6.58 -0.02 1.61 0.01 -1.26 -4.10 114.94 114.86 3cdk s ASN 166 Ca 0.00 2.77 0.05 0.00 -0.71 0.00 0.00 52.86 54.98 3cdk s ASN 166 Cb 0.00 -2.64 -0.01 0.00 0.41 0.00 0.00 41.25 39.01 3cdk s ASN 166 CO 0.00 -0.73 -0.18 -0.76 -1.51 0.00 0.00 177.10 173.92 3cdk s LEU 167 N -0.91 2.01 -0.07 0.60 1.43 -0.06 -1.76 118.68 119.92 3cdk s LEU 167 Ca 0.57 -0.34 0.05 0.00 -1.03 0.00 0.00 54.13 53.38 3cdk s LEU 167 Cb -0.43 -0.95 -0.01 0.00 0.03 0.00 0.00 46.19 44.82 3cdk s LEU 167 CO 0.49 0.21 -0.21 -0.63 0.23 0.00 0.00 176.35 176.43 3cdk s ILE 168 N -0.31 2.41 0.35 -0.59 1.01 -0.67 -0.06 121.20 123.34 3cdk s ILE 168 Ca 0.04 -0.94 0.08 0.00 0.00 0.00 0.00 60.65 59.84 3cdk s ILE 168 Cb -0.08 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 3cdk s ILE 168 CO 0.00 0.57 0.20 -0.36 0.00 0.00 0.00 174.94 175.35 3cdk s PHE 169 N -0.19 2.76 -0.10 3.97 0.08 -1.26 -1.21 117.98 122.02 3cdk s PHE 169 Ca -0.02 -0.37 0.04 0.00 0.12 0.00 0.00 56.93 56.70 3cdk s PHE 169 Cb -0.13 -1.73 0.00 0.00 -0.57 0.00 0.00 43.02 40.59 3cdk s PHE 169 CO 0.03 0.27 -0.23 1.03 -0.10 0.00 0.00 175.22 176.22 3cdk s ARG 170 N -3.90 3.00 3.83 0.44 0.52 -1.26 -4.86 118.95 116.71 3cdk s ARG 170 Ca 0.39 -0.86 0.00 0.00 -0.52 0.00 0.00 55.73 54.74 3cdk s ARG 170 Cb -0.03 -2.29 0.00 0.00 0.52 0.00 0.00 34.95 33.15 3cdk s ARG 170 CO 0.24 0.15 0.00 1.63 0.02 0.00 0.00 175.30 177.34 3cdk n LYS 171 N 3.60 0.00 0.00 3.54 4.76 -1.26 -0.94 118.16 127.86 3cdk n LYS 171 Ca -0.19 0.00 0.16 0.00 -2.87 0.00 0.00 58.31 55.40 3cdk n LYS 171 Cb 0.53 0.00 0.87 0.00 -1.84 0.00 0.00 35.03 34.58 3cdk n LYS 171 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 3cdk n THR 172 N 0.00 0.00 1.12 -0.18 5.66 -1.26 -3.67 114.28 115.96 3cdk n THR 172 Ca 0.00 -0.04 0.11 0.00 -3.05 0.00 0.00 64.05 61.07 3cdk n THR 172 Cb 0.00 -0.34 0.59 0.00 -1.55 0.00 0.00 70.33 69.03 3cdk n THR 172 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3cdk n ALA 173 N -0.84 2.20 -0.05 1.79 0.00 -0.12 -3.85 120.51 119.64 3cdk n ALA 173 Ca 0.22 -0.11 -0.00 0.00 0.00 0.00 0.00 53.44 53.55 3cdk n ALA 173 Cb 0.16 -1.37 -0.00 0.00 0.00 0.00 0.00 19.45 18.24 3cdk n ALA 173 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3cdk h ARG 174 N 0.00 -0.01 0.00 0.00 2.43 -1.69 -3.37 114.38 111.75 3cdk h ARG 174 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3cdk h ARG 174 Cb 0.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3cdk h ARG 174 CO 0.00 -0.00 0.00 0.27 -1.51 0.00 0.00 179.97 178.73 3cdk n ASN 175 N -4.68 0.00 -0.06 -3.80 0.23 -1.25 -0.18 115.26 105.52 3cdk n ASN 175 Ca -0.00 0.00 0.13 0.00 -0.53 0.00 0.00 54.58 54.18 3cdk n ASN 175 Cb 0.00 0.00 0.46 0.00 -2.08 0.00 0.00 39.78 38.16 3cdk n ASN 175 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 3cdk n PHE 176 N 0.06 0.00 0.08 -2.53 3.01 -1.26 -4.46 117.46 112.37 3cdk n PHE 176 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.33 3cdk n PHE 176 Cb 0.00 -0.28 -0.07 0.00 -0.01 0.00 0.00 39.48 39.12 3cdk n PHE 176 CO 0.00 0.00 0.00 -0.91 1.01 0.00 0.00 176.76 176.86 3cdk h ASN 177 N 0.30 -0.11 -0.96 4.37 2.35 -0.89 0.15 115.58 120.79 3cdk h ASN 177 Ca 0.00 -0.03 0.08 0.00 -0.55 0.00 0.00 56.30 55.81 3cdk h ASN 177 Cb 0.46 0.03 -0.07 0.00 0.05 0.00 0.00 38.32 38.79 3cdk h ASN 177 CO 0.00 -0.05 0.62 -0.65 -1.65 0.00 0.00 177.43 175.70 3cdk h PRO 178 N -0.17 1.02 0.12 0.81 0.11 -1.78 -1.33 132.00 130.79 3cdk h PRO 178 Ca -0.01 -0.06 -0.27 0.00 0.11 0.00 0.00 66.00 65.76 3cdk h PRO 178 Cb 0.13 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.02 3cdk h PRO 178 CO 0.02 0.67 -1.23 -0.84 -0.21 0.00 0.00 178.00 176.42 3cdk h ILE 179 N 1.05 1.50 -0.42 4.15 3.07 -1.74 -3.19 117.51 121.92 3cdk h ILE 179 Ca 0.44 -3.04 -0.07 0.00 1.55 0.00 0.00 64.86 63.74 3cdk h ILE 179 Cb 0.29 2.92 -0.02 0.00 -0.27 0.00 0.00 36.82 39.75 3cdk h ILE 179 CO -0.19 0.89 -0.03 0.00 -1.05 0.00 0.00 178.15 177.77 3cdk h ALA 180 N 0.59 1.16 -0.99 0.16 0.00 -0.34 -1.19 119.26 118.65 3cdk h ALA 180 Ca -0.13 -0.26 0.15 0.00 0.00 0.00 0.00 54.91 54.67 3cdk h ALA 180 Cb 1.95 -0.18 -0.09 0.00 0.00 0.00 0.00 17.79 19.47 3cdk h ALA 180 CO 0.20 0.54 0.60 0.00 0.00 0.00 0.00 179.25 180.60 3cdk h ALA 181 N 1.32 1.55 -0.07 0.00 0.00 -1.26 -2.59 119.26 118.20 3cdk h ALA 181 Ca 0.13 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 3cdk h ALA 181 Cb 0.45 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3cdk h ALA 181 CO 0.02 0.09 -0.62 0.52 0.00 0.00 0.00 179.25 179.26 3cdk h MET 182 N 0.87 0.27 0.00 0.00 2.86 -1.21 -3.29 114.93 114.43 3cdk h MET 182 Ca 0.53 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.98 3cdk h MET 182 Cb 0.66 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.35 3cdk h MET 182 CO -0.32 0.81 -0.11 0.00 1.06 0.00 0.00 176.91 178.35 3cdk h ALA 183 N 1.15 0.94 -2.62 6.32 0.00 -1.29 -3.38 119.26 120.37 3cdk h ALA 183 Ca -0.01 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.35 3cdk h ALA 183 Cb 1.14 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 3cdk h ALA 183 CO 0.10 0.00 0.17 0.20 0.00 0.00 0.00 179.25 179.72 3cdk s GLY 184 N -4.03 2.73 0.09 0.00 0.00 -1.13 -2.19 107.32 102.79 3cdk s GLY 184 Ca 0.07 0.26 -0.32 0.00 0.00 0.00 0.00 44.72 44.74 3cdk s GLY 184 CO 0.66 1.29 1.61 1.70 0.00 0.00 0.00 173.10 178.36 3cdk h LYS 185 N 6.54 -0.79 -5.11 2.90 3.64 -1.34 -3.38 116.57 119.03 3cdk h LYS 185 Ca -0.42 0.05 -0.62 0.00 -1.27 0.00 0.00 60.65 58.40 3cdk h LYS 185 Cb 1.20 0.18 -0.15 0.00 -0.41 0.00 0.00 32.23 33.05 3cdk h LYS 185 CO 0.74 -0.53 -0.52 0.42 -2.27 0.00 0.00 179.45 177.30 3cdk s ILE 186 N -6.01 5.22 -0.14 2.00 1.01 -0.86 -5.00 121.20 117.41 3cdk s ILE 186 Ca -0.17 0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.61 3cdk s ILE 186 Cb 0.05 -3.42 -0.01 0.00 0.01 0.00 0.00 42.46 39.09 3cdk s ILE 186 CO 0.63 0.36 -0.15 -0.89 0.00 0.00 0.00 174.94 174.89 3cdk s THR 187 N 0.97 2.74 -0.16 2.92 2.01 -1.26 -0.72 115.64 122.13 3cdk s THR 187 Ca 0.07 -0.76 0.00 0.00 0.31 0.00 0.00 61.69 61.31 3cdk s THR 187 Cb -0.13 -2.15 0.00 0.00 0.01 0.00 0.00 72.50 70.23 3cdk s THR 187 CO 0.04 0.52 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.70 3cdk s ILE 188 N 0.64 2.63 -0.11 1.82 1.01 0.06 -0.53 121.20 126.72 3cdk s ILE 188 Ca -0.08 -0.78 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 3cdk s ILE 188 Cb -0.16 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.17 3cdk s ILE 188 CO 0.03 0.51 -0.05 0.00 0.00 0.00 0.00 174.94 175.43 3cdk s ALA 189 N 0.92 3.03 -0.21 9.38 0.00 0.30 -1.92 121.76 133.25 3cdk s ALA 189 Ca -0.03 -0.85 -0.07 0.00 0.00 0.00 0.00 51.96 51.02 3cdk s ALA 189 Cb -0.15 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.54 3cdk s ALA 189 CO -0.02 0.42 0.04 -2.00 0.00 0.00 0.00 175.76 174.21 3cdk s GLU 190 N -0.31 3.76 -0.03 0.00 2.12 0.53 -0.47 118.70 124.30 3cdk s GLU 190 Ca 0.05 -0.45 0.04 0.00 0.36 0.00 0.00 54.97 54.98 3cdk s GLU 190 Cb -0.12 -3.20 -0.01 0.00 0.26 0.00 0.00 34.13 31.06 3cdk s GLU 190 CO 0.02 0.05 -0.16 0.00 -0.54 0.00 0.00 175.26 174.63 3cdk s ALA 191 N 0.95 1.39 0.12 6.30 0.00 0.71 0.09 121.76 131.33 3cdk s ALA 191 Ca 0.03 -0.66 -0.14 0.00 0.00 0.00 0.00 51.96 51.19 3cdk s ALA 191 Cb -0.14 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 3cdk s ALA 191 CO 0.02 0.29 1.52 0.93 0.00 0.00 0.00 175.76 178.52 3cdk h GLU 192 N 6.05 0.76 -5.64 0.00 5.08 -1.31 0.53 114.58 120.05 3cdk h GLU 192 Ca -0.34 -0.30 -0.64 0.00 -1.00 0.00 0.00 59.36 57.07 3cdk h GLU 192 Cb 1.16 -0.04 -0.32 0.00 0.50 0.00 0.00 28.75 30.06 3cdk h GLU 192 CO 0.48 0.91 -0.87 -1.21 -1.00 0.00 0.00 179.01 177.33 3cdk s GLU 193 N -4.73 2.33 -0.14 2.33 2.02 -0.15 -4.58 118.70 115.79 3cdk s GLU 193 Ca -0.12 -0.79 -0.02 0.00 0.02 0.00 0.00 54.97 54.05 3cdk s GLU 193 Cb 0.10 -1.95 -0.03 0.00 0.10 0.00 0.00 34.13 32.35 3cdk s GLU 193 CO 0.82 0.30 -0.06 0.42 0.02 0.00 0.00 175.26 176.76 3cdk s ILE 194 N 0.00 3.74 0.18 -1.63 -1.09 -1.26 -0.75 121.20 120.39 3cdk s ILE 194 Ca -0.06 -0.42 0.07 0.00 -2.23 0.00 0.00 60.65 58.01 3cdk s ILE 194 Cb -0.14 -2.61 -0.04 0.00 -1.58 0.00 0.00 42.46 38.09 3cdk s ILE 194 CO 0.04 0.52 -0.15 0.68 -1.23 0.00 0.00 174.94 174.80 3cdk s VAL 195 N 0.14 1.64 0.57 2.92 -7.23 0.38 -4.95 120.40 113.89 3cdk s VAL 195 Ca -0.02 -2.09 -0.19 0.00 -1.81 0.00 0.00 61.98 57.86 3cdk s VAL 195 Cb -0.14 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 34.83 3cdk s VAL 195 CO 0.03 -0.55 1.19 -0.70 -0.31 0.00 0.00 175.10 174.76 3cdk s GLU 196 N -3.41 3.10 0.30 4.82 2.12 -1.26 -1.56 118.70 122.80 3cdk s GLU 196 Ca 0.19 1.78 -0.29 0.00 0.36 0.00 0.00 54.97 57.01 3cdk s GLU 196 Cb -0.02 -1.97 -0.10 0.00 0.26 0.00 0.00 34.13 32.30 3cdk s GLU 196 CO 0.06 -1.09 1.34 0.00 -0.54 0.00 0.00 175.26 175.03 3cdk s ALA 197 N -1.63 3.53 0.00 6.30 0.00 -1.26 -1.36 121.76 127.34 3cdk s ALA 197 Ca 0.76 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.98 3cdk s ALA 197 Cb -0.29 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.33 3cdk s ALA 197 CO 0.32 -0.66 0.00 0.41 0.00 0.00 0.00 175.76 175.83 3cdk n GLY 198 N 1.32 1.66 0.17 0.00 0.00 -1.26 -4.92 105.19 102.17 3cdk n GLY 198 Ca 0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.11 3cdk n GLY 198 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3cdk h GLU 199 N 3.20 0.00 -5.19 1.61 4.39 -1.58 -3.44 114.58 113.58 3cdk h GLU 199 Ca 0.00 0.00 -0.61 0.00 0.34 0.00 0.00 59.36 59.09 3cdk h GLU 199 Cb 0.00 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.52 3cdk h GLU 199 CO 0.00 0.28 -0.47 -0.51 -1.16 0.00 0.00 179.01 177.15 3cdk s LEU 200 N -6.33 4.15 -0.02 1.33 1.43 -1.26 -5.04 118.68 112.94 3cdk s LEU 200 Ca 0.05 0.19 -0.33 0.00 -1.03 0.00 0.00 54.13 53.02 3cdk s LEU 200 Cb 0.06 -2.14 -0.11 0.00 0.03 0.00 0.00 46.19 44.03 3cdk s LEU 200 CO 0.71 0.09 1.88 -0.67 0.23 0.00 0.00 176.35 178.60 3cdk n ASP 201 N 4.03 3.66 -0.12 2.29 2.03 -1.26 -4.88 116.55 122.30 3cdk n ASP 201 Ca -0.15 0.96 0.19 0.00 0.52 0.00 0.00 54.79 56.32 3cdk n ASP 201 Cb 0.52 -1.43 0.60 0.00 -0.72 0.00 0.00 41.12 40.09 3cdk n ASP 201 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3cdk h PRO 202 N 9.28 0.21 -0.05 -0.67 0.11 -1.96 0.28 132.00 139.20 3cdk h PRO 202 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3cdk h PRO 202 Cb 1.26 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3cdk h PRO 202 CO 0.94 0.14 0.00 -0.25 -0.21 0.00 0.00 178.00 178.62 3cdk n ASP 203 N -4.42 0.95 -0.03 -2.05 8.00 -1.26 -3.59 116.55 114.15 3cdk n ASP 203 Ca 0.14 -1.43 0.03 0.00 0.71 0.00 0.00 54.79 54.24 3cdk n ASP 203 Cb 0.64 -0.03 -0.12 0.00 -0.02 0.00 0.00 41.12 41.58 3cdk n ASP 203 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3cdk n HIS 204 N -0.22 0.00 -1.66 1.24 8.25 0.93 -5.00 115.22 118.76 3cdk n HIS 204 Ca 0.18 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 57.18 3cdk n HIS 204 Cb 0.24 -0.50 -0.04 0.00 1.12 0.00 0.00 29.99 30.81 3cdk n HIS 204 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 3cdk n ILE 205 N -2.23 0.03 -0.10 1.59 5.41 -0.91 -4.86 119.36 118.29 3cdk n ILE 205 Ca -0.10 -0.01 -0.22 0.00 1.00 0.00 0.00 62.75 63.42 3cdk n ILE 205 Cb 0.62 -1.48 -0.12 0.00 -0.71 0.00 0.00 39.64 37.95 3cdk n ILE 205 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 3cdk n HIS 206 N 3.30 0.43 -4.03 1.39 8.25 0.91 -4.84 115.22 120.64 3cdk n HIS 206 Ca 0.17 0.12 -0.31 0.00 -0.26 0.00 0.00 57.72 57.44 3cdk n HIS 206 Cb 0.28 -1.05 -0.16 0.00 1.12 0.00 0.00 29.99 30.18 3cdk n HIS 206 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3cdk s THR 207 N -2.51 1.85 0.58 1.59 -1.32 -0.86 -5.00 115.64 109.98 3cdk s THR 207 Ca -0.32 -1.23 -0.19 0.00 -1.21 0.00 0.00 61.69 58.73 3cdk s THR 207 Cb 0.09 -1.93 -0.05 0.00 -1.51 0.00 0.00 72.50 69.10 3cdk s THR 207 CO 0.61 0.12 1.00 -2.65 -2.21 0.00 0.00 174.62 171.49 3cdk n PRO 208 N 4.59 0.99 0.28 7.08 -0.02 -1.26 -0.88 135.00 145.78 3cdk n PRO 208 Ca -0.15 0.38 0.19 0.00 -2.02 0.00 0.00 63.50 61.90 3cdk n PRO 208 Cb 0.45 -2.19 0.93 0.00 -0.02 0.00 0.00 33.50 32.67 3cdk n PRO 208 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3cdk h GLY 209 N 0.64 0.00 0.16 -1.23 0.00 -1.77 -2.69 103.07 98.18 3cdk h GLY 209 Ca -0.48 0.00 0.16 0.00 0.00 0.00 0.00 47.33 47.00 3cdk h GLY 209 CO 0.52 0.00 0.43 1.19 0.00 0.00 0.00 176.54 178.68 3cdk h ILE 210 N 0.00 0.69 0.00 2.60 2.10 -1.88 -2.05 117.51 118.97 3cdk h ILE 210 Ca 0.00 -0.20 0.00 0.00 1.08 0.00 0.00 64.86 65.74 3cdk h ILE 210 Cb 0.15 0.05 0.00 0.00 -1.09 0.00 0.00 36.82 35.92 3cdk h ILE 210 CO 0.00 0.11 0.00 -1.22 -1.08 0.00 0.00 178.15 175.96 3cdk n TYR 211 N -4.89 0.00 -4.88 2.19 4.01 -1.01 -4.79 117.16 107.78 3cdk n TYR 211 Ca 0.18 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.59 3cdk n TYR 211 Cb 0.47 -0.28 -0.15 0.00 -0.31 0.00 0.00 39.34 39.07 3cdk n TYR 211 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3cdk s VAL 212 N -2.56 2.70 -0.04 -0.72 1.01 -0.77 -4.51 120.40 115.51 3cdk s VAL 212 Ca 0.25 -0.78 0.14 0.00 0.00 0.00 0.00 61.98 61.58 3cdk s VAL 212 Cb 0.17 -2.11 -0.22 0.00 0.00 0.00 0.00 36.38 34.23 3cdk s VAL 212 CO 0.39 0.53 0.27 0.00 0.00 0.00 0.00 175.10 176.30 3cdk n GLN 213 N 3.59 0.67 -3.77 2.72 0.00 0.31 -4.79 117.38 116.11 3cdk n GLN 213 Ca -0.18 -0.11 -0.13 0.00 0.00 0.00 0.00 57.00 56.57 3cdk n GLN 213 Cb 0.53 -1.35 -0.10 0.00 0.00 0.00 0.00 30.24 29.32 3cdk n GLN 213 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 3cdk s HIS 214 N -2.89 -0.26 -0.03 2.61 3.76 -0.69 -4.79 115.29 112.99 3cdk s HIS 214 Ca -0.06 0.58 0.03 0.00 -0.15 0.00 0.00 55.06 55.46 3cdk s HIS 214 Cb 0.08 0.10 0.00 0.00 1.11 0.00 0.00 32.58 33.88 3cdk s HIS 214 CO 0.60 -0.26 -0.12 0.08 -0.85 0.00 0.00 174.74 174.19 3cdk s VAL 215 N -0.48 1.02 0.03 -0.90 1.01 -0.97 -0.54 120.40 119.57 3cdk s VAL 215 Ca -0.06 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.45 3cdk s VAL 215 Cb -0.04 -0.89 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 3cdk s VAL 215 CO 0.02 0.31 -0.06 0.54 0.00 0.00 0.00 175.10 175.91 3cdk s VAL 216 N 0.17 0.38 -0.01 2.92 0.11 0.38 -0.19 120.40 124.16 3cdk s VAL 216 Ca -0.04 -0.98 -0.25 0.00 -2.93 0.00 0.00 61.98 57.78 3cdk s VAL 216 Cb -0.10 -0.47 -0.04 0.00 -1.53 0.00 0.00 36.38 34.23 3cdk s VAL 216 CO 0.01 -0.40 0.75 -0.22 -3.33 0.00 0.00 175.10 171.91 3cdk s LEU 217 N -1.48 4.38 0.28 2.54 2.96 -1.26 -0.21 118.68 125.90 3cdk s LEU 217 Ca -0.12 1.34 0.10 0.00 -0.22 0.00 0.00 54.13 55.24 3cdk s LEU 217 Cb -0.10 -3.18 -0.05 0.00 0.50 0.00 0.00 46.19 43.36 3cdk s LEU 217 CO -0.00 -0.06 -0.07 -0.83 -1.32 0.00 0.00 176.35 174.07 3cdk s GLY 218 N 0.40 1.79 0.54 7.98 0.00 0.19 -4.78 107.32 113.44 3cdk s GLY 218 Ca 0.39 -1.78 -0.17 0.00 0.00 0.00 0.00 44.72 43.16 3cdk s GLY 218 CO 0.21 -1.83 1.03 0.00 0.00 0.00 0.00 173.10 172.50 3cdk s ALA 219 N -2.42 2.88 0.00 3.20 0.00 -1.26 -4.44 121.76 119.73 3cdk s ALA 219 Ca 0.31 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.66 3cdk s ALA 219 Cb -0.05 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.87 3cdk s ALA 219 CO 0.18 -0.47 0.31 -1.13 0.00 0.00 0.00 175.76 174.65 3cdk n SER 220 N -1.56 0.62 -0.00 0.00 3.41 -1.26 -4.52 113.62 110.30 3cdk n SER 220 Ca 0.08 -0.82 0.10 0.00 -0.26 0.00 0.00 58.87 57.97 3cdk n SER 220 Cb 0.53 0.31 -0.12 0.00 -0.26 0.00 0.00 64.21 64.67 3cdk n SER 220 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3cdk n GLN 221 N -0.31 0.12 -0.06 4.33 6.02 -1.26 -4.26 117.38 121.97 3cdk n GLN 221 Ca 0.00 -0.04 0.12 0.00 -0.01 0.00 0.00 57.00 57.07 3cdk n GLN 221 Cb 0.01 -1.51 0.42 0.00 1.02 0.00 0.00 30.24 30.19 3cdk n GLN 221 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3cdk n GLU 222 N -1.64 1.71 -1.71 -1.09 4.71 -1.26 -4.84 120.64 116.51 3cdk n GLU 222 Ca 0.03 -1.06 -0.43 0.00 -0.01 0.00 0.00 57.16 55.69 3cdk n GLU 222 Cb 0.37 -1.42 -0.03 0.00 -1.01 0.00 0.00 31.44 29.35 3cdk n GLU 222 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 3cdk n LYS 223 N 0.28 2.71 -4.28 3.49 5.02 -1.26 -4.98 118.16 119.14 3cdk n LYS 223 Ca 0.17 0.98 -0.27 0.00 -2.02 0.00 0.00 58.31 57.16 3cdk n LYS 223 Cb 0.34 -2.81 -0.09 0.00 -0.02 0.00 0.00 35.03 32.44 3cdk n LYS 223 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3cdk s ARG 224 N 1.04 2.06 -0.12 1.97 0.52 -1.26 -5.12 118.95 118.03 3cdk s ARG 224 Ca 0.75 -1.23 0.02 0.00 -0.52 0.00 0.00 55.73 54.75 3cdk s ARG 224 Cb -0.52 -2.18 0.01 0.00 0.52 0.00 0.00 34.95 32.78 3cdk s ARG 224 CO 0.34 0.45 -0.20 0.42 0.02 0.00 0.00 175.30 176.32 3cdk s ILE 225 N -1.61 1.86 -0.09 1.52 1.01 -1.26 -4.75 121.20 117.88 3cdk s ILE 225 Ca 0.24 -0.87 -0.17 0.00 0.00 0.00 0.00 60.65 59.85 3cdk s ILE 225 Cb -0.09 -1.66 -0.14 0.00 0.01 0.00 0.00 42.46 40.58 3cdk s ILE 225 CO 0.15 0.51 0.60 -0.08 0.00 0.00 0.00 174.94 176.12 3cdk h GLU 226 N 7.27 -0.10 -4.87 2.79 4.81 -2.00 -3.42 114.58 119.06 3cdk h GLU 226 Ca -0.30 0.01 -0.67 0.00 -0.13 0.00 0.00 59.36 58.26 3cdk h GLU 226 Cb 1.19 0.02 -0.33 0.00 0.63 0.00 0.00 28.75 30.26 3cdk h GLU 226 CO 0.52 0.37 -0.75 0.15 -0.73 0.00 0.00 179.01 178.57 3cdk s LYS 227 N -2.56 2.63 -1.25 1.92 1.02 -1.26 -5.05 119.74 115.19 3cdk s LYS 227 Ca -0.11 -1.11 -0.15 0.00 0.02 0.00 0.00 55.97 54.62 3cdk s LYS 227 Cb -0.01 -3.00 0.13 0.00 -0.52 0.00 0.00 37.83 34.44 3cdk s LYS 227 CO 0.40 -0.48 1.58 0.54 -0.92 0.00 0.00 175.35 176.48 3cdk n ARG 228 N 4.61 3.31 -3.29 1.68 1.74 -1.26 -4.98 116.66 118.47 3cdk n ARG 228 Ca -0.15 -3.61 -0.45 0.00 -0.77 0.00 0.00 57.85 52.87 3cdk n ARG 228 Cb 0.45 -3.19 -0.06 0.00 -1.02 0.00 0.00 32.46 28.64 3cdk n ARG 228 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3cdk s THR 229 N 2.43 5.12 -0.01 0.55 2.01 -1.26 -5.04 115.64 119.43 3cdk s THR 229 Ca 0.47 -1.09 0.07 0.00 0.31 0.00 0.00 61.69 61.45 3cdk s THR 229 Cb 0.01 -4.26 -0.02 0.00 0.01 0.00 0.00 72.50 68.23 3cdk s THR 229 CO 0.03 -0.77 -0.23 0.68 -0.69 0.00 0.00 174.62 173.63 3cdk s VAL 230 N 1.92 1.86 -2.06 3.82 -7.23 -1.26 -5.29 120.40 112.16 3cdk s VAL 230 Ca 0.06 -1.04 0.31 0.00 -1.81 0.00 0.00 61.98 59.51 3cdk s VAL 230 Cb -0.25 -1.55 0.86 0.00 0.56 0.00 0.00 36.38 36.00 3cdk s VAL 230 CO 0.06 0.49 2.17 0.00 -0.31 0.00 0.00 175.10 177.51