#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1afj s THR 2 N 0.00 -0.10 0.35 0.00 -1.32 -1.25 -1.19 115.64 112.14 1afj s THR 2 Ca 0.00 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.51 1afj s THR 2 Cb 0.00 -0.79 -0.04 0.00 -1.51 0.00 0.00 72.50 70.16 1afj s THR 2 CO 0.00 0.00 0.10 0.00 -2.21 0.00 0.00 174.62 172.51 1afj s GLN 3 N 2.99 1.73 -0.03 7.08 -2.07 -0.26 -4.85 119.66 124.25 1afj s GLN 3 Ca 0.01 -2.00 0.05 0.00 -1.82 0.00 0.00 55.36 51.59 1afj s GLN 3 Cb -0.07 -0.63 -0.01 0.00 -1.09 0.00 0.00 33.01 31.22 1afj s GLN 3 CO -0.11 -0.34 -0.17 0.99 -1.32 0.00 0.00 175.29 174.34 1afj s THR 4 N -3.35 1.39 0.24 3.63 2.01 -1.26 -1.29 115.64 117.02 1afj s THR 4 Ca 0.31 -0.73 0.02 0.00 0.31 0.00 0.00 61.69 61.61 1afj s THR 4 Cb 0.06 -1.18 -0.05 0.00 0.01 0.00 0.00 72.50 71.34 1afj s THR 4 CO 0.15 0.40 0.05 0.68 -0.69 0.00 0.00 174.62 175.20 1afj s VAL 5 N -0.20 0.76 0.20 3.82 -7.23 -0.25 -4.91 120.40 112.60 1afj s VAL 5 Ca 0.02 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.25 1afj s VAL 5 Cb -0.09 -2.46 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 1afj s VAL 5 CO 0.01 -0.19 0.13 0.42 -0.31 0.00 0.00 175.10 175.15 1afj s THR 6 N -3.61 4.30 0.05 5.32 -4.23 -0.43 -1.26 115.64 115.79 1afj s THR 6 Ca 0.32 -1.30 0.02 0.00 -1.18 0.00 0.00 61.69 59.55 1afj s THR 6 Cb 0.07 -3.24 -0.03 0.00 1.34 0.00 0.00 72.50 70.64 1afj s THR 6 CO 0.10 -0.21 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.14 1afj s LEU 7 N -3.38 2.31 -0.17 4.79 1.02 0.31 -2.01 118.68 121.55 1afj s LEU 7 Ca 0.31 -0.65 0.00 0.00 0.02 0.00 0.00 54.13 53.81 1afj s LEU 7 Cb -0.09 -0.11 0.03 0.00 0.02 0.00 0.00 46.19 46.05 1afj s LEU 7 CO 0.23 -0.28 -0.11 0.00 0.02 0.00 0.00 176.35 176.21 1afj s ALA 8 N -1.94 1.83 -0.84 4.21 0.00 -0.12 -0.89 121.76 124.01 1afj s ALA 8 Ca -0.05 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 50.93 1afj s ALA 8 Cb -0.06 -1.14 0.24 0.00 0.00 0.00 0.00 23.12 22.15 1afj s ALA 8 CO -0.01 -0.61 0.85 0.28 0.00 0.00 0.00 175.76 176.27 1afj n VAL 9 N 4.76 3.05 0.39 0.00 0.31 -0.94 -1.04 118.33 124.86 1afj n VAL 9 Ca -0.15 -5.24 0.11 0.00 -0.01 0.00 0.00 64.34 59.05 1afj n VAL 9 Cb 0.48 -2.24 0.47 0.00 -0.91 0.00 0.00 33.84 31.64 1afj n VAL 9 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1afj n PRO 10 N 1.72 0.16 -0.32 5.55 -0.04 -1.26 -3.32 135.00 137.50 1afj n PRO 10 Ca 0.24 0.41 0.20 0.00 -0.04 0.00 0.00 63.50 64.32 1afj n PRO 10 Cb 0.37 -1.82 0.41 0.00 -0.04 0.00 0.00 33.50 32.42 1afj n PRO 10 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1afj h GLY 11 N 2.13 1.78 -5.17 0.55 0.00 -1.83 -3.40 103.07 97.12 1afj h GLY 11 Ca 0.00 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 1afj h GLY 11 CO 0.00 -0.50 -0.15 1.06 0.00 0.00 0.00 176.54 176.95 1afj s MET 12 N -5.77 0.57 -0.49 4.80 -1.94 -1.21 -4.95 119.30 110.31 1afj s MET 12 Ca -0.11 0.66 0.05 0.00 -1.71 0.00 0.00 55.69 54.58 1afj s MET 12 Cb 0.29 0.28 0.18 0.00 2.01 0.00 0.00 34.83 37.59 1afj s MET 12 CO 0.78 -0.07 0.42 -2.37 -0.01 0.00 0.00 175.02 173.77 1afj n THR 13 N 2.80 -0.35 -0.34 2.05 5.66 -1.26 -4.00 114.28 118.83 1afj n THR 13 Ca -0.13 -3.90 0.00 0.00 -3.05 0.00 0.00 64.05 56.97 1afj n THR 13 Cb 0.57 -1.83 0.00 0.00 -1.55 0.00 0.00 70.33 67.52 1afj n THR 13 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1afj n ALA 15 N -3.00 5.02 0.00 0.00 0.00 -1.26 -3.78 120.51 117.49 1afj n ALA 15 Ca 0.00 -4.73 0.00 0.00 0.00 0.00 0.00 53.44 48.71 1afj n ALA 15 Cb 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 17.92 1afj n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1afj n ALA 16 N 0.43 0.00 -0.03 0.00 0.00 -1.26 -5.01 120.51 114.64 1afj n ALA 16 Ca 0.34 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.63 1afj n ALA 16 Cb 0.35 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.68 1afj n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1afj h PRO 18 N -0.67 -0.45 -0.18 0.00 0.11 -1.81 0.18 132.00 129.18 1afj h PRO 18 Ca -0.03 0.03 0.05 0.00 0.11 0.00 0.00 66.00 66.16 1afj h PRO 18 Cb 1.03 0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1afj h PRO 18 CO 0.04 -0.30 0.16 0.82 -0.21 0.00 0.00 178.00 178.50 1afj h ILE 19 N -0.47 0.68 0.00 4.15 2.04 -1.87 0.11 117.51 122.16 1afj h ILE 19 Ca 0.08 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.91 1afj h ILE 19 Cb 0.60 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1afj h ILE 19 CO -0.36 0.00 -0.15 0.74 0.00 0.00 0.00 178.15 178.38 1afj h THR 20 N 0.00 0.56 -0.07 -0.27 2.02 -0.48 -1.03 112.91 113.64 1afj h THR 20 Ca 0.09 -0.68 -0.11 0.00 0.77 0.00 0.00 66.41 66.48 1afj h THR 20 Cb 0.40 1.45 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 1afj h THR 20 CO -0.00 0.14 -0.43 0.58 0.37 0.00 0.00 175.52 176.18 1afj h VAL 21 N 0.00 1.32 -0.34 3.16 2.07 -0.35 -1.40 116.25 120.71 1afj h VAL 21 Ca -0.00 -1.56 -0.17 0.00 0.82 0.00 0.00 66.70 65.79 1afj h VAL 21 Cb 0.43 1.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1afj h VAL 21 CO 0.02 0.46 -0.46 0.50 0.02 0.00 0.00 177.57 178.11 1afj h LYS 22 N 0.14 0.91 0.00 1.57 3.64 -1.21 -2.36 116.57 119.26 1afj h LYS 22 Ca 0.01 -0.52 -0.01 0.00 -1.27 0.00 0.00 60.65 58.86 1afj h LYS 22 Cb 0.83 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1afj h LYS 22 CO 0.06 1.17 -0.04 -0.22 -2.27 0.00 0.00 179.45 178.15 1afj h LYS 23 N 0.71 0.00 0.13 1.90 3.11 -1.20 -2.61 116.57 118.61 1afj h LYS 23 Ca 0.04 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.87 1afj h LYS 23 Cb 1.06 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.29 1afj h LYS 23 CO 0.11 0.04 -0.06 0.00 -2.81 0.00 0.00 179.45 176.73 1afj h ALA 24 N 1.96 -0.18 -0.01 5.00 0.00 -0.74 -1.65 119.26 123.63 1afj h ALA 24 Ca -0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1afj h ALA 24 Cb 0.46 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1afj h ALA 24 CO 0.01 -0.29 -0.07 -0.07 0.00 0.00 0.00 179.25 178.83 1afj h LEU 25 N -0.80 0.02 -0.70 0.00 3.38 -1.40 0.36 115.31 116.16 1afj h LEU 25 Ca -0.02 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 1afj h LEU 25 Cb 0.54 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1afj h LEU 25 CO 0.03 0.09 -0.51 0.28 0.09 0.00 0.00 178.44 178.42 1afj h SER 26 N 0.02 0.00 -0.44 -0.43 0.02 -1.44 -2.97 113.55 108.31 1afj h SER 26 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1afj h SER 26 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1afj h SER 26 CO 0.01 0.51 0.00 2.29 -1.14 0.00 0.00 176.83 178.50 1afj n LYS 27 N -3.56 2.46 0.00 3.45 -0.00 -0.13 -4.69 118.16 115.69 1afj n LYS 27 Ca -0.00 -2.24 0.00 0.00 -0.00 0.00 0.00 58.31 56.07 1afj n LYS 27 Cb 0.60 -1.45 0.00 0.00 -0.00 0.00 0.00 35.03 34.18 1afj n LYS 27 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1afj n VAL 28 N 1.25 0.00 0.00 0.58 0.31 0.11 -5.01 118.33 115.57 1afj n VAL 28 Ca 0.18 1.11 0.00 0.00 -0.01 0.00 0.00 64.34 65.62 1afj n VAL 28 Cb 0.54 -2.02 0.00 0.00 -0.91 0.00 0.00 33.84 31.46 1afj n VAL 28 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1afj n GLU 29 N -0.96 0.00 0.00 5.55 1.02 -1.26 -4.93 120.64 120.06 1afj n GLU 29 Ca 0.00 0.00 0.16 0.00 -0.02 0.00 0.00 57.16 57.30 1afj n GLU 29 Cb 0.00 0.00 0.90 0.00 -0.02 0.00 0.00 31.44 32.32 1afj n GLU 29 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1afj n GLY 30 N 0.00 -1.03 3.49 0.62 0.00 -1.26 -4.90 105.19 102.11 1afj n GLY 30 Ca 0.00 -0.20 -0.53 0.00 0.00 0.00 0.00 46.02 45.29 1afj n GLY 30 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1afj n VAL 31 N -1.02 0.80 0.10 1.61 3.14 -1.26 -2.51 118.33 119.19 1afj n VAL 31 Ca 0.22 -0.20 0.05 0.00 -2.96 0.00 0.00 64.34 61.45 1afj n VAL 31 Cb 0.14 -0.21 -0.08 0.00 -1.06 0.00 0.00 33.84 32.63 1afj n VAL 31 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1afj n SER 32 N 1.79 2.12 -3.52 6.55 7.64 -0.52 -4.83 113.62 122.85 1afj n SER 32 Ca 0.18 -0.15 -0.09 0.00 1.01 0.00 0.00 58.87 59.82 1afj n SER 32 Cb 0.17 1.39 -0.02 0.00 -1.01 0.00 0.00 64.21 64.74 1afj n SER 32 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1afj s LYS 33 N -2.59 0.77 -0.11 1.43 2.20 -1.02 -4.95 119.74 115.47 1afj s LYS 33 Ca -0.02 -0.23 -0.21 0.00 -0.36 0.00 0.00 55.97 55.15 1afj s LYS 33 Cb 0.07 0.36 0.05 0.00 -1.51 0.00 0.00 37.83 36.80 1afj s LYS 33 CO 0.44 -0.33 0.51 0.08 -0.36 0.00 0.00 175.35 175.70 1afj s VAL 34 N -2.81 0.02 0.04 4.02 1.01 -1.26 -1.68 120.40 119.72 1afj s VAL 34 Ca 0.04 -0.12 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 1afj s VAL 34 Cb -0.01 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.58 1afj s VAL 34 CO -0.07 -0.07 0.03 -0.62 0.00 0.00 0.00 175.10 174.36 1afj s ASP 35 N -0.51 0.28 0.11 3.32 -1.08 0.19 -5.00 116.67 113.98 1afj s ASP 35 Ca -0.06 -0.64 -0.19 0.00 -0.52 0.00 0.00 52.55 51.14 1afj s ASP 35 Cb -0.03 0.18 0.04 0.00 -1.46 0.00 0.00 42.92 41.65 1afj s ASP 35 CO 0.04 -0.47 0.46 -0.69 0.52 0.00 0.00 175.17 175.03 1afj s VAL 36 N -2.59 0.05 -0.61 1.11 1.01 -1.26 -0.81 120.40 117.29 1afj s VAL 36 Ca -0.05 -0.39 0.04 0.00 0.00 0.00 0.00 61.98 61.58 1afj s VAL 36 Cb -0.01 -1.08 0.16 0.00 0.00 0.00 0.00 36.38 35.45 1afj s VAL 36 CO -0.05 -0.22 0.42 -0.83 0.00 0.00 0.00 175.10 174.43 1afj s GLY 37 N -2.56 2.49 0.00 4.51 0.00 0.45 -4.97 107.32 107.24 1afj s GLY 37 Ca 0.00 -3.44 0.00 0.00 0.00 0.00 0.00 44.72 41.28 1afj s GLY 37 CO -0.09 1.29 0.00 1.97 0.00 0.00 0.00 173.10 176.27 1afj n PHE 38 N 2.36 0.00 -0.15 1.90 1.16 -1.26 -1.52 117.46 119.95 1afj n PHE 38 Ca 0.19 0.00 0.09 0.00 -1.87 0.00 0.00 57.45 55.87 1afj n PHE 38 Cb 0.37 0.00 0.18 0.00 -1.61 0.00 0.00 39.48 38.42 1afj n PHE 38 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 1afj n GLU 39 N 0.00 -0.03 -1.49 3.97 4.71 -1.25 0.23 120.64 126.78 1afj n GLU 39 Ca 0.00 0.64 -0.27 0.00 -0.01 0.00 0.00 57.16 57.52 1afj n GLU 39 Cb 0.00 -1.06 -0.06 0.00 -1.01 0.00 0.00 31.44 29.30 1afj n GLU 39 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1afj n LYS 40 N -4.29 2.54 0.00 3.49 4.01 -0.58 -4.71 118.16 118.63 1afj n LYS 40 Ca 0.13 -2.33 0.00 0.00 -0.51 0.00 0.00 58.31 55.60 1afj n LYS 40 Cb 0.43 -2.17 0.00 0.00 -0.51 0.00 0.00 35.03 32.77 1afj n LYS 40 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 1afj n ARG 41 N 1.07 0.00 -3.38 1.97 -4.01 0.62 -4.62 116.66 108.31 1afj n ARG 41 Ca 0.50 0.00 -0.11 0.00 -1.04 0.00 0.00 57.85 57.19 1afj n ARG 41 Cb 0.56 0.00 -0.09 0.00 -3.04 0.00 0.00 32.46 29.88 1afj n ARG 41 CO 0.00 0.00 0.00 -2.00 -3.04 0.00 0.00 177.63 172.59 1afj s GLU 42 N 0.00 0.31 -0.17 2.89 -6.30 -1.09 -2.23 118.70 112.11 1afj s GLU 42 Ca 0.00 0.44 -0.04 0.00 -2.50 0.00 0.00 54.97 52.87 1afj s GLU 42 Cb 0.00 -0.65 -0.02 0.00 0.00 0.00 0.00 34.13 33.46 1afj s GLU 42 CO 0.00 -0.66 -0.04 0.00 0.02 0.00 0.00 175.26 174.58 1afj s ALA 43 N 2.49 2.92 -0.23 6.30 0.00 -0.07 -0.41 121.76 132.76 1afj s ALA 43 Ca 0.11 -0.94 -0.06 0.00 0.00 0.00 0.00 51.96 51.08 1afj s ALA 43 Cb -0.15 -1.59 -0.02 0.00 0.00 0.00 0.00 23.12 21.36 1afj s ALA 43 CO -0.16 0.01 0.03 0.08 0.00 0.00 0.00 175.76 175.72 1afj s VAL 44 N 0.73 4.00 0.17 0.00 1.01 0.01 0.11 120.40 126.43 1afj s VAL 44 Ca -0.02 -0.28 0.08 0.00 0.00 0.00 0.00 61.98 61.76 1afj s VAL 44 Cb -0.15 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 1afj s VAL 44 CO 0.02 0.38 -0.17 0.54 0.00 0.00 0.00 175.10 175.87 1afj s VAL 45 N 1.47 1.73 0.17 2.92 0.11 -0.39 -0.64 120.40 125.77 1afj s VAL 45 Ca 0.05 -1.94 0.10 0.00 -2.93 0.00 0.00 61.98 57.27 1afj s VAL 45 Cb -0.15 -1.83 -0.04 0.00 -1.53 0.00 0.00 36.38 32.83 1afj s VAL 45 CO 0.01 -0.39 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.28 1afj s THR 46 N -2.24 2.18 0.09 5.04 2.01 -0.68 -1.09 115.64 120.95 1afj s THR 46 Ca 0.16 -1.92 -0.25 0.00 0.31 0.00 0.00 61.69 59.99 1afj s THR 46 Cb -0.05 -2.00 0.08 0.00 0.01 0.00 0.00 72.50 70.55 1afj s THR 46 CO 0.06 -0.11 1.16 0.72 -0.69 0.00 0.00 174.62 175.75 1afj s PHE 47 N -1.59 0.06 -0.33 4.92 -0.12 -0.41 -1.44 117.98 119.07 1afj s PHE 47 Ca 0.17 -0.33 -0.09 0.00 -0.05 0.00 0.00 56.93 56.64 1afj s PHE 47 Cb -0.08 0.64 0.02 0.00 -0.63 0.00 0.00 43.02 42.97 1afj s PHE 47 CO 0.08 -0.62 0.14 -0.51 -0.05 0.00 0.00 175.22 174.26 1afj s ASP 48 N -3.64 5.45 0.00 1.98 1.01 -1.04 -1.10 116.67 119.33 1afj s ASP 48 Ca 0.26 -0.87 0.04 0.00 0.71 0.00 0.00 52.55 52.69 1afj s ASP 48 Cb -0.02 -1.95 0.17 0.00 1.01 0.00 0.00 42.92 42.13 1afj s ASP 48 CO 0.03 -0.29 1.04 -0.67 0.21 0.00 0.00 175.17 175.49 1afj n ASP 49 N 4.92 0.00 0.01 0.27 2.03 -0.33 -1.71 116.55 121.74 1afj n ASP 49 Ca -0.13 0.39 0.08 0.00 0.52 0.00 0.00 54.79 55.65 1afj n ASP 49 Cb 0.47 -0.41 0.37 0.00 -0.72 0.00 0.00 41.12 40.82 1afj n ASP 49 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1afj n THR 50 N -1.41 0.84 0.00 5.18 5.66 -1.25 -3.99 114.28 119.31 1afj n THR 50 Ca 0.01 0.21 0.00 0.00 -3.05 0.00 0.00 64.05 61.22 1afj n THR 50 Cb 0.04 -0.93 0.00 0.00 -1.55 0.00 0.00 70.33 67.89 1afj n THR 50 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1afj n LYS 51 N -1.54 0.00 -1.99 1.09 5.02 -0.69 -5.08 118.16 114.97 1afj n LYS 51 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1afj n LYS 51 Cb 0.20 -0.69 0.00 0.00 -0.02 0.00 0.00 35.03 34.52 1afj n LYS 51 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1afj n ALA 52 N -1.88 0.00 -3.56 7.82 0.00 -0.92 -4.58 120.51 117.39 1afj n ALA 52 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1afj n ALA 52 Cb 0.19 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.60 1afj n ALA 52 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1afj s SER 53 N -0.99 -0.33 0.55 0.00 0.01 -1.26 -4.00 113.70 107.68 1afj s SER 53 Ca 0.00 0.22 0.48 0.00 1.31 0.00 0.00 55.95 57.97 1afj s SER 53 Cb 0.00 0.30 1.71 0.00 0.21 0.00 0.00 66.02 68.25 1afj s SER 53 CO 0.00 -0.41 1.60 1.62 0.41 0.00 0.00 173.24 176.46 1afj h VAL 54 N 2.31 0.05 0.00 3.43 3.04 -1.99 1.08 116.25 124.18 1afj h VAL 54 Ca -0.18 -0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.51 1afj h VAL 54 Cb 1.19 0.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.52 1afj h VAL 54 CO 0.30 0.00 -0.00 -0.61 -1.01 0.00 0.00 177.57 176.25 1afj h GLN 55 N 0.00 -0.00 0.00 4.17 4.15 -1.99 -2.83 115.11 118.61 1afj h GLN 55 Ca 0.90 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 60.31 1afj h GLN 55 Cb 3.58 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 31.27 1afj h GLN 55 CO -0.03 0.50 -0.03 0.87 -1.93 0.00 0.00 178.83 178.22 1afj h LYS 56 N -0.51 0.00 0.06 1.69 1.57 0.80 0.63 116.57 120.82 1afj h LYS 56 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1afj h LYS 56 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1afj h LYS 56 CO 0.00 0.03 -0.03 -0.07 -0.57 0.00 0.00 179.45 178.81 1afj h LEU 57 N 0.00 -0.07 -1.97 2.94 3.38 -1.10 0.36 115.31 118.85 1afj h LEU 57 Ca -0.00 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1afj h LEU 57 Cb 0.13 0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1afj h LEU 57 CO 0.00 0.52 0.00 0.74 0.09 0.00 0.00 178.44 179.79 1afj h THR 58 N -0.70 0.00 0.00 0.22 2.02 -1.22 -0.15 112.91 113.09 1afj h THR 58 Ca -0.01 -0.28 -0.09 0.00 0.77 0.00 0.00 66.41 66.80 1afj h THR 58 Cb 0.58 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1afj h THR 58 CO 0.01 0.00 -0.63 0.50 0.37 0.00 0.00 175.52 175.77 1afj h LYS 59 N 0.00 0.00 -0.14 6.66 1.63 -0.59 -0.36 116.57 123.77 1afj h LYS 59 Ca 0.00 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.65 1afj h LYS 59 Cb 0.29 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.92 1afj h LYS 59 CO 0.00 0.35 -0.49 0.00 -3.45 0.00 0.00 179.45 175.87 1afj h ALA 60 N 1.60 0.25 0.03 5.00 0.00 0.99 0.31 119.26 127.43 1afj h ALA 60 Ca -0.03 -0.49 -0.26 0.00 0.00 0.00 0.00 54.91 54.12 1afj h ALA 60 Cb 1.34 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 19.12 1afj h ALA 60 CO 0.05 0.42 -1.06 0.00 0.00 0.00 0.00 179.25 178.66 1afj h THR 61 N 0.22 1.33 0.00 0.00 1.03 -1.57 -0.36 112.91 113.56 1afj h THR 61 Ca -0.02 -2.39 -0.01 0.00 -0.01 0.00 0.00 66.41 63.97 1afj h THR 61 Cb 1.11 2.48 -0.00 0.00 -1.07 0.00 0.00 68.15 70.67 1afj h THR 61 CO 0.10 0.73 -0.06 0.00 -0.01 0.00 0.00 175.52 176.28 1afj h ALA 62 N 0.50 1.51 0.00 0.00 0.00 -1.03 0.18 119.26 120.42 1afj h ALA 62 Ca -0.12 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1afj h ALA 62 Cb 1.71 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.48 1afj h ALA 62 CO 0.20 0.07 -0.82 0.22 0.00 0.00 0.00 179.25 178.92 1afj h ASP 63 N 0.00 0.00 1.05 0.00 3.58 0.04 -3.12 116.42 117.97 1afj h ASP 63 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1afj h ASP 63 Cb 0.14 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.19 1afj h ASP 63 CO 0.01 0.42 0.00 0.00 -2.88 0.00 0.00 179.24 176.79 1afj h ALA 64 N 1.58 1.00 0.00 -0.78 0.00 0.11 -3.45 119.26 117.71 1afj h ALA 64 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1afj h ALA 64 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1afj h ALA 64 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 1afj n GLY 65 N 0.12 1.95 2.57 0.00 0.00 -0.81 -5.08 105.19 103.94 1afj n GLY 65 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1afj n GLY 65 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1afj s TYR 66 N -2.00 1.44 -0.71 1.61 2.02 -0.57 -4.88 117.35 114.26 1afj s TYR 66 Ca 0.00 -2.16 -0.28 0.00 -0.37 0.00 0.00 57.07 54.26 1afj s TYR 66 Cb 0.00 -1.39 -0.14 0.00 -0.40 0.00 0.00 41.96 40.03 1afj s TYR 66 CO 0.00 -0.79 2.54 -2.30 -1.57 0.00 0.00 175.55 173.42 1afj n PRO 67 N 3.51 0.59 -1.09 -1.71 -0.02 -1.26 -3.45 135.00 131.57 1afj n PRO 67 Ca 0.14 -0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1afj n PRO 67 Cb 0.38 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 1afj n PRO 67 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1afj n SER 68 N 13.56 0.77 -3.70 2.55 3.41 -1.26 -3.90 113.62 125.04 1afj n SER 68 Ca 0.50 -0.79 -0.11 0.00 -0.26 0.00 0.00 58.87 58.21 1afj n SER 68 Cb 0.32 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.16 1afj n SER 68 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1afj s SER 69 N -0.84 -0.45 0.23 4.04 0.01 -0.21 -4.96 113.70 111.52 1afj s SER 69 Ca 0.00 0.82 0.03 0.00 1.31 0.00 0.00 55.95 58.11 1afj s SER 69 Cb 0.00 0.71 -0.03 0.00 0.21 0.00 0.00 66.02 66.91 1afj s SER 69 CO 0.00 -0.19 0.37 0.54 0.41 0.00 0.00 173.24 174.37 1afj s VAL 70 N 1.42 5.25 -0.30 3.43 0.11 -1.26 -0.94 120.40 128.10 1afj s VAL 70 Ca -0.09 -0.81 0.19 0.00 -2.93 0.00 0.00 61.98 58.33 1afj s VAL 70 Cb -0.09 -3.82 0.48 0.00 -1.53 0.00 0.00 36.38 31.41 1afj s VAL 70 CO -0.12 -0.29 1.03 2.29 -3.33 0.00 0.00 175.10 174.69 1afj n LYS 71 N -1.20 1.64 -0.33 1.54 2.85 -0.85 -4.97 118.16 116.85 1afj n LYS 71 Ca -0.08 -3.48 0.00 0.00 -1.05 0.00 0.00 58.31 53.70 1afj n LYS 71 Cb 0.56 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.44 1afj n LYS 71 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29