#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 -0.33 0.13 0.00 -4.23 -1.25 -1.98 115.64 107.97 1afj s THR 2 Ca 0.00 -1.07 0.08 0.00 -1.18 0.00 0.00 61.69 59.52 1afj s THR 2 Cb 0.00 -0.66 -0.04 0.00 1.34 0.00 0.00 72.50 73.15 1afj s THR 2 CO 0.00 -0.59 -0.19 0.00 -0.54 0.00 0.00 174.62 173.29 1afj s GLN 3 N 1.32 1.18 0.16 3.99 -2.07 0.42 -4.84 119.66 119.82 1afj s GLN 3 Ca 0.18 -1.27 0.11 0.00 -1.82 0.00 0.00 55.36 52.56 1afj s GLN 3 Cb -0.14 -1.34 -0.04 0.00 -1.09 0.00 0.00 33.01 30.40 1afj s GLN 3 CO -0.03 0.29 -0.24 -0.08 -1.32 0.00 0.00 175.29 173.91 1afj s THR 4 N -1.57 2.21 0.27 3.63 -1.32 -1.26 -1.60 115.64 116.00 1afj s THR 4 Ca 0.10 -1.89 0.00 0.00 -1.21 0.00 0.00 61.69 58.69 1afj s THR 4 Cb -0.08 -2.01 -0.03 0.00 -1.51 0.00 0.00 72.50 68.88 1afj s THR 4 CO 0.05 -0.07 0.27 0.68 -2.21 0.00 0.00 174.62 173.34 1afj s VAL 5 N -1.48 0.00 0.27 5.08 -7.23 -0.19 -4.88 120.40 111.97 1afj s VAL 5 Ca 0.17 -1.87 0.08 0.00 -1.81 0.00 0.00 61.98 58.54 1afj s VAL 5 Cb -0.08 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 1afj s VAL 5 CO 0.08 0.00 0.15 0.28 -0.31 0.00 0.00 175.10 175.30 1afj s THR 6 N -3.74 3.98 0.00 5.32 -1.32 -1.24 -1.21 115.64 117.43 1afj s THR 6 Ca 0.37 -1.55 0.04 0.00 -1.21 0.00 0.00 61.69 59.33 1afj s THR 6 Cb 0.04 -3.20 -0.01 0.00 -1.51 0.00 0.00 72.50 67.81 1afj s THR 6 CO 0.18 -0.32 -0.12 -0.76 -2.21 0.00 0.00 174.62 171.38 1afj s LEU 7 N -3.82 2.07 -0.42 9.08 1.02 0.34 -1.72 118.68 125.23 1afj s LEU 7 Ca 0.34 -0.29 -0.06 0.00 0.02 0.00 0.00 54.13 54.14 1afj s LEU 7 Cb -0.07 -0.61 0.11 0.00 0.02 0.00 0.00 46.19 45.64 1afj s LEU 7 CO 0.24 0.11 0.24 0.00 0.02 0.00 0.00 176.35 176.96 1afj s ALA 8 N -0.46 3.23 -0.86 4.21 0.00 -0.58 -1.67 121.76 125.63 1afj s ALA 8 Ca 0.03 -2.44 -0.00 0.00 0.00 0.00 0.00 51.96 49.55 1afj s ALA 8 Cb -0.06 -2.55 0.21 0.00 0.00 0.00 0.00 23.12 20.73 1afj s ALA 8 CO 0.00 -1.79 0.74 1.55 0.00 0.00 0.00 175.76 176.27 1afj n VAL 9 N 4.74 2.77 0.67 0.00 3.14 -1.26 -0.08 118.33 128.32 1afj n VAL 9 Ca -0.06 -5.09 0.06 0.00 -2.96 0.00 0.00 64.34 56.30 1afj n VAL 9 Cb 0.41 -2.33 0.34 0.00 -1.06 0.00 0.00 33.84 31.20 1afj n VAL 9 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1afj n PRO 10 N 2.17 0.27 0.25 1.45 -0.04 -1.26 -3.15 135.00 134.68 1afj n PRO 10 Ca 0.22 0.10 0.14 0.00 -0.04 0.00 0.00 63.50 63.91 1afj n PRO 10 Cb 0.37 -1.50 0.73 0.00 -0.04 0.00 0.00 33.50 33.05 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 2.03 0.00 -0.16 0.55 0.00 -1.86 -3.43 103.07 100.19 1afj h GLY 11 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1afj h GLY 11 CO 0.00 0.00 0.01 1.03 0.00 0.00 0.00 176.54 177.58 1afj n MET 12 N -2.55 0.12 0.00 4.80 2.81 -1.19 -4.97 117.12 116.14 1afj n MET 12 Ca -0.02 -0.32 0.00 0.00 -1.81 0.00 0.00 57.70 55.55 1afj n MET 12 Cb 0.20 0.35 0.00 0.00 -0.71 0.00 0.00 33.22 33.06 1afj n MET 12 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 1afj n THR 13 N -0.07 0.00 -3.84 2.03 5.66 -1.26 -4.81 114.28 112.00 1afj n THR 13 Ca -0.01 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 1afj n THR 13 Cb 0.08 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 68.85 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 -0.49 2.72 0.00 0.00 0.00 -1.26 -3.45 120.51 118.03 1afj n ALA 15 Ca -0.06 -3.38 0.00 0.00 0.00 0.00 0.00 53.44 50.01 1afj n ALA 15 Cb 0.59 -3.54 0.00 0.00 0.00 0.00 0.00 19.45 16.50 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 11.35 0.00 -0.06 0.00 0.00 -1.26 -5.00 120.51 125.53 1afj n ALA 16 Ca 0.47 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.69 1afj n ALA 16 Cb 0.45 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.78 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 -0.44 0.70 -0.23 0.00 0.11 -1.78 0.13 132.00 130.50 1afj h PRO 18 Ca -0.43 -0.07 0.07 0.00 0.11 0.00 0.00 66.00 65.67 1afj h PRO 18 Cb 1.71 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.67 1afj h PRO 18 CO -0.09 0.52 0.17 0.82 -0.21 0.00 0.00 178.00 179.21 1afj h ILE 19 N 0.68 0.85 0.00 4.15 2.04 -1.80 0.24 117.51 123.68 1afj h ILE 19 Ca 0.18 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.99 1afj h ILE 19 Cb 0.00 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1afj h ILE 19 CO -0.03 0.00 -0.23 0.74 0.00 0.00 0.00 178.15 178.63 1afj h THR 20 N 0.00 1.01 0.00 -0.27 2.02 -0.78 -0.43 112.91 114.46 1afj h THR 20 Ca 0.11 -0.83 -0.06 0.00 0.77 0.00 0.00 66.41 66.39 1afj h THR 20 Cb 0.44 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 1afj h THR 20 CO -0.00 0.23 -0.31 0.58 0.37 0.00 0.00 175.52 176.39 1afj h VAL 21 N 0.00 0.96 -0.26 3.16 2.07 -0.06 -1.72 116.25 120.40 1afj h VAL 21 Ca -0.00 -1.16 -0.11 0.00 0.82 0.00 0.00 66.70 66.24 1afj h VAL 21 Cb 0.45 1.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1afj h VAL 21 CO 0.03 0.30 -0.27 0.50 0.02 0.00 0.00 177.57 178.15 1afj h LYS 22 N 0.00 0.64 0.00 1.57 3.64 -0.99 -2.30 116.57 119.13 1afj h LYS 22 Ca -0.00 -0.34 -0.03 0.00 -1.27 0.00 0.00 60.65 59.01 1afj h LYS 22 Cb 0.65 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1afj h LYS 22 CO 0.04 0.95 -0.12 0.87 -2.27 0.00 0.00 179.45 178.91 1afj h LYS 23 N 0.37 0.00 -0.32 1.90 6.56 -1.25 -2.52 116.57 121.31 1afj h LYS 23 Ca 0.04 0.00 -0.09 0.00 -1.06 0.00 0.00 60.65 59.54 1afj h LYS 23 Cb 0.83 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.48 1afj h LYS 23 CO 0.07 0.12 -0.17 0.00 -2.06 0.00 0.00 179.45 177.42 1afj h ALA 24 N 1.88 0.45 -0.35 3.86 0.00 -0.78 -1.17 119.26 123.15 1afj h ALA 24 Ca -0.00 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.44 1afj h ALA 24 Cb 0.35 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1afj h ALA 24 CO 0.02 0.36 -0.26 -0.07 0.00 0.00 0.00 179.25 179.30 1afj h LEU 25 N 0.44 0.83 -1.54 0.00 3.38 -1.09 0.15 115.31 117.46 1afj h LEU 25 Ca 0.07 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1afj h LEU 25 Cb 0.70 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1afj h LEU 25 CO 0.05 1.10 0.00 0.77 0.09 0.00 0.00 178.44 180.45 1afj h SER 26 N 0.57 0.00 0.01 -0.43 4.64 -1.45 -1.54 113.55 115.35 1afj h SER 26 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1afj h SER 26 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1afj h SER 26 CO 0.07 0.00 -0.95 0.29 -0.87 0.00 0.00 176.83 175.37 1afj n LYS 27 N -2.80 0.08 -0.11 4.77 4.01 -0.45 -4.50 118.16 119.17 1afj n LYS 27 Ca 0.00 -0.07 -0.09 0.00 -0.51 0.00 0.00 58.31 57.65 1afj n LYS 27 Cb 0.22 -1.50 -0.06 0.00 -0.51 0.00 0.00 35.03 33.18 1afj n LYS 27 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1afj h VAL 28 N 0.16 0.00 0.00 -0.18 2.07 0.35 -3.47 116.25 115.18 1afj h VAL 28 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1afj h VAL 28 Cb 0.52 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1afj h VAL 28 CO 0.00 0.00 0.00 1.21 0.02 0.00 0.00 177.57 178.80 1afj n GLU 29 N -4.43 0.00 0.00 1.57 2.13 -1.26 -4.93 120.64 113.72 1afj n GLU 29 Ca -0.02 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.92 1afj n GLU 29 Cb 0.22 0.00 0.20 0.00 0.27 0.00 0.00 31.44 32.13 1afj n GLU 29 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1afj n GLY 30 N 0.00 -0.70 3.54 8.31 0.00 -1.26 -4.95 105.19 110.13 1afj n GLY 30 Ca 0.00 -0.46 -0.58 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.86 0.01 0.54 1.61 3.14 -1.26 -3.76 118.33 117.75 1afj n VAL 31 Ca 0.09 -0.00 0.06 0.00 -2.96 0.00 0.00 64.34 61.53 1afj n VAL 31 Cb 0.37 -0.21 -0.07 0.00 -1.06 0.00 0.00 33.84 32.86 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 1.92 0.71 -3.48 6.55 7.64 -0.40 -4.94 113.62 121.62 1afj n SER 32 Ca 0.20 -0.73 -0.10 0.00 1.01 0.00 0.00 58.87 59.26 1afj n SER 32 Cb 0.09 1.05 -0.02 0.00 -1.01 0.00 0.00 64.21 64.32 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 -2.24 0.96 0.09 1.43 2.47 -1.00 -4.95 119.74 116.50 1afj s LYS 33 Ca 0.04 -0.33 -0.09 0.00 -1.56 0.00 0.00 55.97 54.03 1afj s LYS 33 Cb 0.09 0.44 0.00 0.00 -1.46 0.00 0.00 37.83 36.91 1afj s LYS 33 CO 0.51 -0.41 0.21 0.08 0.16 0.00 0.00 175.35 175.90 1afj s VAL 34 N -3.22 0.14 -0.02 4.02 1.01 -1.26 -1.60 120.40 119.47 1afj s VAL 34 Ca 0.03 -1.14 0.01 0.00 0.00 0.00 0.00 61.98 60.88 1afj s VAL 34 Cb -0.01 -1.34 0.01 0.00 0.00 0.00 0.00 36.38 35.04 1afj s VAL 34 CO -0.10 -0.62 -0.03 -0.62 0.00 0.00 0.00 175.10 173.74 1afj s ASP 35 N -2.86 0.51 -0.17 3.32 -1.08 0.63 -4.90 116.67 112.12 1afj s ASP 35 Ca 0.05 -0.07 -0.04 0.00 -0.52 0.00 0.00 52.55 51.98 1afj s ASP 35 Cb 0.05 -0.15 -0.02 0.00 -1.46 0.00 0.00 42.92 41.33 1afj s ASP 35 CO -0.11 -0.01 -0.03 0.54 0.52 0.00 0.00 175.17 176.08 1afj s VAL 36 N 0.36 3.82 -0.81 1.11 0.11 -1.26 -2.04 120.40 121.69 1afj s VAL 36 Ca -0.04 -0.37 0.02 0.00 -2.93 0.00 0.00 61.98 58.66 1afj s VAL 36 Cb -0.07 -2.70 0.33 0.00 -1.53 0.00 0.00 36.38 32.42 1afj s VAL 36 CO -0.01 0.47 1.43 0.61 -3.33 0.00 0.00 175.10 174.27 1afj n GLY 37 N 3.88 5.89 0.00 6.54 0.00 0.39 -4.94 105.19 116.95 1afj n GLY 37 Ca -0.17 -2.68 0.00 0.00 0.00 0.00 0.00 46.02 43.17 1afj n GLY 37 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1afj n PHE 38 N -0.17 0.00 -0.14 1.61 1.16 -1.26 0.12 117.46 118.77 1afj n PHE 38 Ca 0.40 0.00 -0.04 0.00 -1.87 0.00 0.00 57.45 55.94 1afj n PHE 38 Cb 0.33 0.00 0.02 0.00 -1.61 0.00 0.00 39.48 38.22 1afj n PHE 38 CO 0.00 0.00 0.00 1.49 -1.87 0.00 0.00 176.76 176.38 1afj h GLU 39 N 0.00 -0.01 0.00 3.97 4.81 -1.83 0.05 114.58 121.56 1afj h GLU 39 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1afj h GLU 39 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1afj h GLU 39 CO 0.00 -0.01 0.17 1.17 -0.73 0.00 0.00 179.01 179.61 1afj n LYS 40 N -5.34 0.09 -2.70 1.92 0.00 -1.20 -4.04 118.16 106.89 1afj n LYS 40 Ca 0.03 0.56 -0.04 0.00 0.00 0.00 0.00 58.31 58.86 1afj n LYS 40 Cb 0.25 -1.97 0.01 0.00 0.00 0.00 0.00 35.03 33.31 1afj n LYS 40 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1afj n ARG 41 N -2.01 -2.64 -3.37 1.64 0.00 0.31 -5.04 116.66 105.55 1afj n ARG 41 Ca -0.01 2.27 0.02 0.00 -0.00 0.00 0.00 57.85 60.13 1afj n ARG 41 Cb 0.19 -5.27 -0.04 0.00 0.00 0.00 0.00 32.46 27.34 1afj n ARG 41 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 1afj s GLU 42 N -2.10 0.24 -0.21 -0.14 2.56 -0.80 -4.39 118.70 113.85 1afj s GLU 42 Ca 0.14 0.59 -0.03 0.00 0.00 0.00 0.00 54.97 55.68 1afj s GLU 42 Cb -0.04 0.35 0.00 0.00 2.00 0.00 0.00 34.13 36.44 1afj s GLU 42 CO 0.72 -0.08 -0.08 0.00 -0.56 0.00 0.00 175.26 175.26 1afj s ALA 43 N 2.31 2.69 -0.21 6.30 0.00 -0.67 0.15 121.76 132.33 1afj s ALA 43 Ca -0.02 -1.21 -0.06 0.00 0.00 0.00 0.00 51.96 50.67 1afj s ALA 43 Cb -0.05 -1.59 -0.03 0.00 0.00 0.00 0.00 23.12 21.46 1afj s ALA 43 CO -0.17 -0.45 0.03 0.08 0.00 0.00 0.00 175.76 175.25 1afj s VAL 44 N 1.42 4.14 0.07 0.00 1.01 -0.87 0.13 120.40 126.30 1afj s VAL 44 Ca 0.05 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 61.82 1afj s VAL 44 Cb -0.14 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 1afj s VAL 44 CO -0.06 0.40 -0.10 0.54 0.00 0.00 0.00 175.10 175.89 1afj s VAL 45 N 1.14 0.79 0.14 2.92 0.11 -0.35 0.23 120.40 125.39 1afj s VAL 45 Ca 0.03 -1.34 0.08 0.00 -2.93 0.00 0.00 61.98 57.82 1afj s VAL 45 Cb -0.14 -0.99 -0.04 0.00 -1.53 0.00 0.00 36.38 33.68 1afj s VAL 45 CO 0.02 -0.42 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.39 1afj s THR 46 N -1.79 3.35 0.14 5.04 2.01 -0.62 -1.02 115.64 122.75 1afj s THR 46 Ca -0.03 -1.44 -0.23 0.00 0.31 0.00 0.00 61.69 60.30 1afj s THR 46 Cb -0.07 -2.62 0.08 0.00 0.01 0.00 0.00 72.50 69.90 1afj s THR 46 CO 0.00 -0.01 1.09 2.22 -0.69 0.00 0.00 174.62 177.24 1afj n PHE 47 N 0.33 -1.14 -3.96 4.92 1.16 -0.63 -1.28 117.46 116.87 1afj n PHE 47 Ca -0.12 -1.15 -0.35 0.00 -1.87 0.00 0.00 57.45 53.96 1afj n PHE 47 Cb 0.54 0.55 -0.12 0.00 -1.61 0.00 0.00 39.48 38.84 1afj n PHE 47 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1afj s ASP 48 N -3.54 5.03 0.00 5.98 1.11 -1.25 -0.44 116.67 123.57 1afj s ASP 48 Ca 0.25 -0.17 0.11 0.00 0.18 0.00 0.00 52.55 52.92 1afj s ASP 48 Cb -0.02 -1.88 0.64 0.00 1.07 0.00 0.00 42.92 42.73 1afj s ASP 48 CO 0.04 0.04 1.19 -0.90 1.18 0.00 0.00 175.17 176.72 1afj n ASP 49 N 4.39 0.00 0.15 0.27 5.75 -0.84 -1.44 116.55 124.83 1afj n ASP 49 Ca -0.17 -0.15 0.05 0.00 -0.01 0.00 0.00 54.79 54.51 1afj n ASP 49 Cb 0.52 -0.12 0.05 0.00 -1.03 0.00 0.00 41.12 40.54 1afj n ASP 49 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1afj h THR 50 N 0.00 0.54 0.00 2.12 1.03 -1.93 -3.36 112.91 111.32 1afj h THR 50 Ca 0.00 -1.79 0.00 0.00 -0.01 0.00 0.00 66.41 64.61 1afj h THR 50 Cb 0.04 2.22 0.00 0.00 -1.07 0.00 0.00 68.15 69.34 1afj h THR 50 CO 0.00 0.31 0.00 0.29 -0.01 0.00 0.00 175.52 176.11 1afj n LYS 51 N -3.13 2.66 -1.31 0.00 5.02 -0.91 -5.07 118.16 115.42 1afj n LYS 51 Ca 0.01 -0.15 -0.00 0.00 -2.02 0.00 0.00 58.31 56.15 1afj n LYS 51 Cb 0.68 -0.57 -0.00 0.00 -0.02 0.00 0.00 35.03 35.12 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 -0.42 -0.01 0.00 7.82 0.00 -0.52 -4.07 120.51 123.30 1afj n ALA 52 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1afj n ALA 52 Cb 0.03 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.49 1afj n ALA 52 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1afj n SER 53 N -1.59 0.00 -0.33 0.00 7.64 -1.26 -4.00 113.62 114.08 1afj n SER 53 Ca -0.00 0.00 0.24 0.00 1.01 0.00 0.00 58.87 60.12 1afj n SER 53 Cb 0.00 0.00 0.47 0.00 -1.01 0.00 0.00 64.21 63.67 1afj n SER 53 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 1afj h VAL 54 N 0.02 0.11 -0.43 0.44 -1.51 -1.98 0.93 116.25 113.83 1afj h VAL 54 Ca 0.00 -0.04 -0.00 0.00 -1.23 0.00 0.00 66.70 65.43 1afj h VAL 54 Cb 0.00 -0.00 -0.02 0.00 -2.13 0.00 0.00 31.29 29.14 1afj h VAL 54 CO 0.00 0.02 0.27 -0.61 -1.23 0.00 0.00 177.57 176.01 1afj h GLN 55 N 0.10 0.57 0.00 5.19 5.75 -1.98 -1.53 115.11 123.21 1afj h GLN 55 Ca 0.74 -0.05 -0.04 0.00 -0.15 0.00 0.00 58.65 59.16 1afj h GLN 55 Cb 1.77 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 30.20 1afj h GLN 55 CO -0.75 0.41 -0.17 -0.22 -2.65 0.00 0.00 178.83 175.45 1afj h LYS 56 N 0.57 0.00 0.24 1.69 3.64 0.45 0.27 116.57 123.43 1afj h LYS 56 Ca 0.15 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1afj h LYS 56 Cb -0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1afj h LYS 56 CO -0.03 0.17 -0.11 -0.07 -2.27 0.00 0.00 179.45 177.13 1afj h LEU 57 N 0.00 -0.27 -1.81 5.20 3.38 -0.22 -0.41 115.31 121.19 1afj h LEU 57 Ca -0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1afj h LEU 57 Cb 0.41 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1afj h LEU 57 CO 0.02 0.24 0.00 0.74 0.09 0.00 0.00 178.44 179.53 1afj h THR 58 N -0.95 0.00 0.00 0.22 2.02 -1.21 0.09 112.91 113.08 1afj h THR 58 Ca -0.03 -0.17 -0.18 0.00 0.77 0.00 0.00 66.41 66.80 1afj h THR 58 Cb 0.48 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 1afj h THR 58 CO 0.05 0.00 -0.93 0.50 0.37 0.00 0.00 175.52 175.52 1afj h LYS 59 N 0.00 0.00 -0.18 6.66 3.64 -0.27 -0.02 116.57 126.39 1afj h LYS 59 Ca 0.00 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 1afj h LYS 59 Cb 0.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1afj h LYS 59 CO 0.00 0.73 -0.36 0.00 -2.27 0.00 0.00 179.45 177.55 1afj h ALA 60 N 1.20 0.29 -0.06 5.00 0.00 0.78 0.82 119.26 127.29 1afj h ALA 60 Ca -0.05 -0.44 -0.21 0.00 0.00 0.00 0.00 54.91 54.22 1afj h ALA 60 Cb 1.65 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1afj h ALA 60 CO 0.10 0.36 -0.81 0.00 0.00 0.00 0.00 179.25 178.89 1afj h THR 61 N 0.22 1.36 0.00 0.00 1.03 -1.56 0.98 112.91 114.96 1afj h THR 61 Ca 0.01 -2.21 -0.01 0.00 -0.01 0.00 0.00 66.41 64.19 1afj h THR 61 Cb 0.96 2.19 -0.00 0.00 -1.07 0.00 0.00 68.15 70.23 1afj h THR 61 CO 0.08 0.67 -0.04 0.00 -0.01 0.00 0.00 175.52 176.22 1afj h ALA 62 N 0.79 1.90 0.00 0.00 0.00 -0.90 0.12 119.26 121.18 1afj h ALA 62 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1afj h ALA 62 Cb 1.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1afj h ALA 62 CO 0.15 0.05 -0.80 -0.25 0.00 0.00 0.00 179.25 178.40 1afj n ASP 63 N -4.45 0.69 0.21 0.00 9.92 0.27 -3.56 116.55 119.62 1afj n ASP 63 Ca -0.03 0.06 0.13 0.00 -0.53 0.00 0.00 54.79 54.42 1afj n ASP 63 Cb 0.13 0.39 0.36 0.00 -0.64 0.00 0.00 41.12 41.35 1afj n ASP 63 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1afj h ALA 64 N 2.45 1.00 0.00 2.24 0.00 0.18 -3.46 119.26 121.67 1afj h ALA 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1afj h ALA 64 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1afj h ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1afj n GLY 65 N 0.79 1.92 2.54 0.00 0.00 -0.82 -5.07 105.19 104.56 1afj n GLY 65 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 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 0.42 -0.65 1.61 2.02 -0.45 -4.94 117.35 113.35 1afj s TYR 66 Ca 0.00 -1.37 -0.26 0.00 -0.37 0.00 0.00 57.07 55.07 1afj s TYR 66 Cb 0.00 -0.77 -0.12 0.00 -0.40 0.00 0.00 41.96 40.67 1afj s TYR 66 CO 0.00 -0.87 2.45 -2.30 -1.57 0.00 0.00 175.55 173.27 1afj n PRO 67 N 4.16 0.73 -0.46 -1.71 -0.02 -1.26 -3.27 135.00 133.17 1afj n PRO 67 Ca 0.11 -0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1afj n PRO 67 Cb 0.39 -3.06 0.00 0.00 -0.02 0.00 0.00 33.50 30.81 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 15.09 0.85 -2.13 2.55 3.41 -1.26 -4.23 113.62 127.90 1afj n SER 68 Ca 0.45 -0.32 -0.09 0.00 -0.26 0.00 0.00 58.87 58.65 1afj n SER 68 Cb 0.42 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.35 1afj n SER 68 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1afj n SER 69 N -0.69 -0.71 -3.90 4.04 7.64 0.89 -4.91 113.62 115.98 1afj n SER 69 Ca 0.00 -2.08 -0.12 0.00 1.01 0.00 0.00 58.87 57.68 1afj n SER 69 Cb 0.00 1.35 -0.13 0.00 -1.01 0.00 0.00 64.21 64.41 1afj n SER 69 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1afj s VAL 70 N -2.66 0.07 -0.53 0.44 0.11 -1.26 -1.53 120.40 115.04 1afj s VAL 70 Ca 0.17 -0.21 0.04 0.00 -2.93 0.00 0.00 61.98 59.05 1afj s VAL 70 Cb -0.00 -0.10 0.17 0.00 -1.53 0.00 0.00 36.38 34.92 1afj s VAL 70 CO 0.12 -0.09 0.41 1.17 -3.33 0.00 0.00 175.10 173.38 1afj n LYS 71 N 2.76 0.87 0.00 1.54 4.81 -0.70 -4.97 118.16 122.47 1afj n LYS 71 Ca -0.15 -3.72 0.00 0.00 -0.87 0.00 0.00 58.31 53.58 1afj n LYS 71 Cb 0.59 -1.92 0.00 0.00 0.02 0.00 0.00 35.03 33.71 1afj n LYS 71 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51