#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2di0 s SER 2 N 0.00 6.62 -0.56 1.61 0.01 -1.26 -5.05 113.70 115.06 2di0 s SER 2 Ca 0.00 0.81 0.04 0.00 1.31 0.00 0.00 55.95 58.11 2di0 s SER 2 Cb 0.00 -2.18 0.15 0.00 0.21 0.00 0.00 66.02 64.20 2di0 s SER 2 CO 0.00 0.07 0.34 -0.55 0.41 0.00 0.00 173.24 173.52 2di0 s SER 3 N -2.07 4.21 -1.23 2.44 0.15 -1.26 -4.84 113.70 111.09 2di0 s SER 3 Ca 0.39 -3.25 -0.12 0.00 0.70 0.00 0.00 55.95 53.67 2di0 s SER 3 Cb -0.13 -1.46 -0.01 0.00 -1.71 0.00 0.00 66.02 62.71 2di0 s SER 3 CO 0.21 -0.18 0.68 0.61 1.20 0.00 0.00 173.24 175.76 2di0 n GLY 4 N 2.76 -0.69 2.86 9.45 0.00 -1.26 -3.72 105.19 114.58 2di0 n GLY 4 Ca 0.12 0.33 -0.01 0.00 0.00 0.00 0.00 46.02 46.46 2di0 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2di0 n SER 5 N -2.82 -7.65 -3.93 1.61 2.88 -1.26 -5.04 113.62 97.41 2di0 n SER 5 Ca -0.18 1.12 -0.13 0.00 -1.33 0.00 0.00 58.87 58.35 2di0 n SER 5 Cb 0.63 -4.37 -0.14 0.00 -0.75 0.00 0.00 64.21 59.58 2di0 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2di0 s SER 6 N -1.52 0.31 0.00 -3.46 0.15 -1.24 -5.13 113.70 102.80 2di0 s SER 6 Ca 0.02 -0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.54 2di0 s SER 6 Cb -0.00 -0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.30 2di0 s SER 6 CO 0.59 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.62 2di0 n GLY 7 N 2.75 4.50 2.77 9.45 0.00 -1.26 -4.79 105.19 118.60 2di0 n GLY 7 Ca -0.14 -1.25 -0.03 0.00 0.00 0.00 0.00 46.02 44.60 2di0 n GLY 7 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2di0 n MET 8 N -1.90 -3.41 0.00 1.61 1.56 -1.26 -4.95 117.12 108.77 2di0 n MET 8 Ca 0.00 2.69 0.00 0.00 -0.27 0.00 0.00 57.70 60.12 2di0 n MET 8 Cb 0.00 -4.06 0.00 0.00 2.15 0.00 0.00 33.22 31.31 2di0 n MET 8 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2di0 n GLY 10 N -1.10 0.70 0.32 0.00 0.00 -1.26 -4.40 105.19 99.45 2di0 n GLY 10 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 2di0 n GLY 10 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2di0 h VAL 11 N 0.00 0.36 -0.88 1.61 -1.51 -2.00 0.57 116.25 114.41 2di0 h VAL 11 Ca 0.00 -0.11 0.23 0.00 -1.23 0.00 0.00 66.70 65.59 2di0 h VAL 11 Cb 0.00 0.01 -0.14 0.00 -2.13 0.00 0.00 31.29 29.02 2di0 h VAL 11 CO 0.00 0.06 0.22 -0.33 -1.23 0.00 0.00 177.57 176.29 2di0 h GLU 12 N 0.33 0.19 0.54 5.19 3.07 -1.97 1.20 114.58 123.14 2di0 h GLU 12 Ca 0.63 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 59.45 2di0 h GLU 12 Cb 1.32 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 2di0 h GLU 12 CO -0.60 0.13 -0.27 1.25 -1.40 0.00 0.00 179.01 178.12 2di0 h LEU 13 N 0.20 -0.65 -1.48 1.33 6.46 -0.06 -1.61 115.31 119.49 2di0 h LEU 13 Ca 0.55 0.03 0.05 0.00 -0.12 0.00 0.00 57.88 58.39 2di0 h LEU 13 Cb 1.10 0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 41.17 2di0 h LEU 13 CO -0.66 -0.46 0.41 -0.78 -0.62 0.00 0.00 178.44 176.33 2di0 h ASP 14 N -0.75 0.56 0.40 1.25 1.82 -0.62 -2.49 116.42 116.60 2di0 h ASP 14 Ca -0.07 -0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.56 2di0 h ASP 14 Cb 0.58 -0.12 -0.03 0.00 0.68 0.00 0.00 39.33 40.44 2di0 h ASP 14 CO 0.11 0.37 -0.49 -1.28 -1.61 0.00 0.00 179.24 176.35 2di0 h SER 15 N 0.64 -1.36 -0.73 2.28 0.87 0.20 0.27 113.55 115.72 2di0 h SER 15 Ca 0.26 0.12 0.14 0.00 -1.23 0.00 0.00 61.79 61.08 2di0 h SER 15 Cb 0.23 0.46 -0.14 0.00 -0.44 0.00 0.00 62.40 62.51 2di0 h SER 15 CO -0.08 -0.61 -0.21 -0.07 -0.53 0.00 0.00 176.83 175.33 2di0 h LEU 16 N -0.91 -0.77 0.13 2.23 3.38 -0.87 0.31 115.31 118.80 2di0 h LEU 16 Ca -0.05 0.23 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 2di0 h LEU 16 Cb 0.81 0.48 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 2di0 h LEU 16 CO -0.10 -0.25 -0.13 0.40 0.09 0.00 0.00 178.44 178.44 2di0 h ILE 17 N -0.02 0.00 -0.97 1.22 2.04 -1.13 -1.50 117.51 117.14 2di0 h ILE 17 Ca 0.34 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.37 2di0 h ILE 17 Cb 0.54 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.45 2di0 h ILE 17 CO -0.76 0.00 -0.31 -1.20 0.00 0.00 0.00 178.15 175.88 2di0 n SER 18 N -3.12 -0.50 -0.14 1.72 7.64 0.89 0.15 113.62 120.26 2di0 n SER 18 Ca -0.03 1.69 -0.08 0.00 1.01 0.00 0.00 58.87 61.45 2di0 n SER 18 Cb 0.12 -0.45 -0.03 0.00 -1.01 0.00 0.00 64.21 62.85 2di0 n SER 18 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2di0 h GLN 19 N 0.00 -0.26 0.36 1.43 4.20 -0.07 1.38 115.11 122.14 2di0 h GLN 19 Ca 0.40 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 59.11 2di0 h GLN 19 Cb 0.64 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.49 2di0 h GLN 19 CO -0.98 -0.18 -0.17 0.28 -0.67 0.00 0.00 178.83 177.11 2di0 h VAL 20 N -0.27 0.61 -0.71 -0.54 2.07 0.10 -3.07 116.25 114.44 2di0 h VAL 20 Ca 0.16 -0.53 0.11 0.00 0.82 0.00 0.00 66.70 67.27 2di0 h VAL 20 Cb 0.57 0.86 -0.13 0.00 -1.52 0.00 0.00 31.29 31.07 2di0 h VAL 20 CO -0.59 0.10 -0.37 0.50 0.02 0.00 0.00 177.57 177.22 2di0 h LYS 21 N -0.80 -0.12 -1.26 1.57 3.11 0.20 1.71 116.57 120.98 2di0 h LYS 21 Ca -0.05 0.01 0.38 0.00 -2.81 0.00 0.00 60.65 58.18 2di0 h LYS 21 Cb 0.52 0.03 -0.11 0.00 -1.00 0.00 0.00 32.23 31.67 2di0 h LYS 21 CO 0.08 -0.08 0.82 -0.44 -2.81 0.00 0.00 179.45 177.02 2di0 h ASP 22 N -0.13 0.27 0.37 4.20 5.19 0.19 1.56 116.42 128.07 2di0 h ASP 22 Ca 0.25 0.10 -0.32 0.00 -0.62 0.00 0.00 57.03 56.45 2di0 h ASP 22 Cb 0.56 0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.15 2di0 h ASP 22 CO -0.77 -0.08 -1.57 -0.07 -3.12 0.00 0.00 179.24 173.63 2di0 h LEU 23 N 0.17 0.49 -6.36 1.55 3.38 0.22 -3.39 115.31 111.36 2di0 h LEU 23 Ca 0.74 -0.67 -0.59 0.00 0.09 0.00 0.00 57.88 57.44 2di0 h LEU 23 Cb 2.29 -0.16 -0.41 0.00 0.09 0.00 0.00 40.66 42.47 2di0 h LEU 23 CO -0.33 1.56 -0.77 0.18 0.09 0.00 0.00 178.44 179.17 2di0 n LEU 24 N -3.52 2.15 0.20 1.67 4.77 0.43 -4.89 117.00 117.82 2di0 n LEU 24 Ca -0.18 -5.07 0.08 0.00 -0.03 0.00 0.00 56.01 50.81 2di0 n LEU 24 Cb 1.06 -0.20 0.30 0.00 -2.33 0.00 0.00 43.42 42.24 2di0 n LEU 24 CO 0.52 1.97 0.71 1.55 -1.33 0.00 0.00 177.39 180.81 2di0 h PRO 25 N 4.59 0.00 -0.12 3.23 0.13 0.12 -3.21 132.00 136.74 2di0 h PRO 25 Ca 0.17 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.33 2di0 h PRO 25 Cb 0.77 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.87 2di0 h PRO 25 CO 0.66 0.28 -0.06 -0.44 -0.23 0.00 0.00 178.00 178.20 2di0 h ASP 26 N 0.00 -0.20 -3.85 1.44 3.32 -1.90 -3.42 116.42 111.81 2di0 h ASP 26 Ca -0.00 0.05 -0.48 0.00 0.02 0.00 0.00 57.03 56.62 2di0 h ASP 26 Cb 0.96 0.11 0.18 0.00 0.22 0.00 0.00 39.33 40.81 2di0 h ASP 26 CO 0.04 -0.08 0.16 -0.76 -1.72 0.00 0.00 179.24 176.88 2di0 s LEU 27 N -10.35 1.90 -0.06 1.55 1.43 -1.21 -4.84 118.68 107.11 2di0 s LEU 27 Ca -0.14 1.66 -0.09 0.00 -1.03 0.00 0.00 54.13 54.53 2di0 s LEU 27 Cb 0.09 -3.89 -0.05 0.00 0.03 0.00 0.00 46.19 42.37 2di0 s LEU 27 CO 0.68 -3.29 0.25 -0.83 0.23 0.00 0.00 176.35 173.39 2di0 s GLY 28 N -2.94 2.28 0.21 -3.19 0.00 0.21 -4.91 107.32 98.98 2di0 s GLY 28 Ca 0.66 -0.49 -0.17 0.00 0.00 0.00 0.00 44.72 44.72 2di0 s GLY 28 CO 0.60 -0.21 1.60 0.83 0.00 0.00 0.00 173.10 175.92 2di0 h GLU 29 N 4.71 -0.08 -0.98 2.90 5.08 -1.86 0.31 114.58 124.66 2di0 h GLU 29 Ca -0.53 0.01 0.32 0.00 -1.00 0.00 0.00 59.36 58.16 2di0 h GLU 29 Cb 1.22 0.02 -0.18 0.00 0.50 0.00 0.00 28.75 30.31 2di0 h GLU 29 CO 0.61 -0.05 0.20 0.41 -1.00 0.00 0.00 179.01 179.17 2di0 n GLY 30 N -1.46 -1.13 0.08 -3.84 0.00 0.93 0.20 105.19 99.97 2di0 n GLY 30 Ca 0.07 0.91 -0.10 0.00 0.00 0.00 0.00 46.02 46.90 2di0 n GLY 30 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2di0 h PHE 31 N 0.00 0.19 -0.21 1.61 3.57 -0.43 -2.39 116.94 119.28 2di0 h PHE 31 Ca 0.68 -0.13 -0.14 0.00 3.53 0.00 0.00 57.97 61.92 2di0 h PHE 31 Cb 1.57 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 40.29 2di0 h PHE 31 CO -0.33 1.07 -0.43 0.82 -2.23 0.00 0.00 178.31 177.20 2di0 h ILE 32 N 0.04 1.31 0.23 1.41 2.04 0.42 -2.37 117.51 120.58 2di0 h ILE 32 Ca -0.05 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.18 2di0 h ILE 32 Cb 1.77 1.61 0.00 0.00 -0.74 0.00 0.00 36.82 39.47 2di0 h ILE 32 CO 0.15 0.50 -0.11 0.25 0.00 0.00 0.00 178.15 178.95 2di0 h LEU 33 N 0.43 -0.26 -0.69 1.44 7.12 0.21 -2.43 115.31 121.13 2di0 h LEU 33 Ca 0.03 -0.27 0.12 0.00 0.13 0.00 0.00 57.88 57.90 2di0 h LEU 33 Cb 0.93 0.07 -0.13 0.00 -0.53 0.00 0.00 40.66 41.00 2di0 h LEU 33 CO 0.08 0.21 -0.32 0.00 -0.13 0.00 0.00 178.44 178.29 2di0 h ALA 34 N -0.30 0.09 0.06 1.25 0.00 -1.43 0.30 119.26 119.24 2di0 h ALA 34 Ca -0.03 0.21 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2di0 h ALA 34 Cb 0.51 0.78 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 2di0 h ALA 34 CO 0.05 -0.62 -0.35 0.00 0.00 0.00 0.00 179.25 178.33 2di0 h LEU 36 N -0.49 -1.35 -0.53 0.00 3.38 -0.56 1.48 115.31 117.23 2di0 h LEU 36 Ca -0.00 0.20 0.05 0.00 0.09 0.00 0.00 57.88 58.22 2di0 h LEU 36 Cb 0.50 0.59 -0.08 0.00 0.09 0.00 0.00 40.66 41.76 2di0 h LEU 36 CO -0.20 -0.18 -0.45 -0.33 0.09 0.00 0.00 178.44 177.36 2di0 h GLU 37 N -0.07 -0.17 -0.24 1.13 5.08 -0.05 1.69 114.58 121.94 2di0 h GLU 37 Ca 0.09 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 2di0 h GLU 37 Cb 0.30 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2di0 h GLU 37 CO -0.55 -0.11 0.21 -0.92 -1.00 0.00 0.00 179.01 176.64 2di0 h TYR 38 N -0.17 0.00 -1.77 4.33 5.03 0.95 -1.62 116.97 123.72 2di0 h TYR 38 Ca 0.09 0.00 -0.73 0.00 2.58 0.00 0.00 58.73 60.67 2di0 h TYR 38 Cb 0.40 0.00 -0.29 0.00 1.55 0.00 0.00 36.73 38.39 2di0 h TYR 38 CO -0.84 0.00 0.80 0.66 -1.32 0.00 0.00 178.16 177.46 2di0 n TYR 39 N -4.10 3.06 -4.12 -3.82 4.01 0.49 -4.87 117.16 107.81 2di0 n TYR 39 Ca 0.03 -2.51 -0.32 0.00 -0.16 0.00 0.00 57.90 54.94 2di0 n TYR 39 Cb 0.35 -1.09 -0.06 0.00 -0.31 0.00 0.00 39.34 38.23 2di0 n TYR 39 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2di0 n HIS 40 N -0.59 -1.16 -4.08 -0.72 8.25 -0.61 0.63 115.22 116.95 2di0 n HIS 40 Ca 0.53 0.42 -0.32 0.00 -0.26 0.00 0.00 57.72 58.09 2di0 n HIS 40 Cb 0.36 -2.51 -0.05 0.00 1.12 0.00 0.00 29.99 28.90 2di0 n HIS 40 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2di0 n TYR 41 N -4.35 -1.13 -4.97 4.41 4.01 0.50 -4.91 117.16 110.71 2di0 n TYR 41 Ca -0.25 0.36 -0.32 0.00 -0.16 0.00 0.00 57.90 57.52 2di0 n TYR 41 Cb 0.60 -2.43 -0.16 0.00 -0.31 0.00 0.00 39.34 37.04 2di0 n TYR 41 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2di0 s ASP 42 N -4.04 3.42 -0.06 7.72 -1.08 0.21 -4.96 116.67 117.88 2di0 s ASP 42 Ca 0.15 -0.49 -0.13 0.00 -0.52 0.00 0.00 52.55 51.57 2di0 s ASP 42 Cb -0.09 -1.49 -0.09 0.00 -1.46 0.00 0.00 42.92 39.80 2di0 s ASP 42 CO 0.87 0.15 0.51 1.55 0.52 0.00 0.00 175.17 178.77 2di0 h PRO 43 N 6.82 -0.26 -0.60 4.34 0.13 -1.89 -3.21 132.00 137.34 2di0 h PRO 43 Ca -0.24 0.02 0.09 0.00 -0.87 0.00 0.00 66.00 65.00 2di0 h PRO 43 Cb 1.22 0.06 -0.11 0.00 0.13 0.00 0.00 31.00 32.30 2di0 h PRO 43 CO 0.51 -0.03 -0.42 0.93 -0.23 0.00 0.00 178.00 178.76 2di0 h GLU 44 N -1.02 -0.20 -0.85 0.86 5.08 -1.97 0.56 114.58 117.03 2di0 h GLU 44 Ca -0.03 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.47 2di0 h GLU 44 Cb 0.36 0.05 -0.14 0.00 0.50 0.00 0.00 28.75 29.52 2di0 h GLU 44 CO 0.05 -0.14 -0.41 1.96 -1.00 0.00 0.00 179.01 179.47 2di0 h GLN 45 N -0.21 -0.07 0.04 2.33 4.20 -1.93 1.45 115.11 120.93 2di0 h GLN 45 Ca 0.19 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.90 2di0 h GLN 45 Cb 0.56 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 2di0 h GLN 45 CO -0.70 -0.05 -0.03 0.28 -0.67 0.00 0.00 178.83 177.67 2di0 h VAL 46 N -0.07 0.00 -0.99 -0.54 2.07 -0.98 0.43 116.25 116.16 2di0 h VAL 46 Ca 0.27 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.96 2di0 h VAL 46 Cb 0.56 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.16 2di0 h VAL 46 CO -0.87 0.00 -0.35 0.40 0.02 0.00 0.00 177.57 176.77 2di0 h ILE 47 N -0.07 0.00 0.21 4.57 2.04 -0.27 0.51 117.51 124.50 2di0 h ILE 47 Ca -0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.86 2di0 h ILE 47 Cb 0.06 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.10 2di0 h ILE 47 CO 0.00 0.00 -0.50 0.78 0.00 0.00 0.00 178.15 178.43 2di0 h ASN 48 N -0.00 -1.47 -0.02 1.72 2.35 0.22 0.47 115.58 118.84 2di0 h ASN 48 Ca 0.38 0.15 0.01 0.00 -0.55 0.00 0.00 56.30 56.29 2di0 h ASN 48 Cb 0.64 0.53 -0.01 0.00 0.05 0.00 0.00 38.32 39.52 2di0 h ASN 48 CO -1.00 -0.57 -0.12 0.78 -1.65 0.00 0.00 177.43 174.87 2di0 h ASN 49 N -0.79 -0.38 -0.97 5.81 2.35 0.38 0.77 115.58 122.75 2di0 h ASN 49 Ca -0.01 0.04 0.21 0.00 -0.55 0.00 0.00 56.30 55.99 2di0 h ASN 49 Cb 0.77 0.15 -0.18 0.00 0.05 0.00 0.00 38.32 39.11 2di0 h ASN 49 CO -0.23 -0.11 -0.19 0.40 -1.65 0.00 0.00 177.43 175.65 2di0 h ILE 50 N -0.13 0.03 -0.41 2.81 2.04 -0.06 1.76 117.51 123.55 2di0 h ILE 50 Ca 0.01 -0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.91 2di0 h ILE 50 Cb 0.15 0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 36.22 2di0 h ILE 50 CO -0.09 0.00 0.18 -0.07 0.00 0.00 0.00 178.15 178.17 2di0 h LEU 51 N 0.00 0.24 -2.30 1.44 3.38 0.13 0.72 115.31 118.93 2di0 h LEU 51 Ca 0.49 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.48 2di0 h LEU 51 Cb 0.80 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2di0 h LEU 51 CO -0.98 0.18 0.01 -0.62 0.09 0.00 0.00 178.44 177.12 2di0 n GLU 52 N -4.96 2.90 -2.89 1.13 -0.58 0.47 -4.86 120.64 111.86 2di0 n GLU 52 Ca 0.02 -1.57 -0.08 0.00 -0.42 0.00 0.00 57.16 55.12 2di0 n GLU 52 Cb 0.12 -1.87 -0.02 0.00 -0.57 0.00 0.00 31.44 29.11 2di0 n GLU 52 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2di0 n GLU 53 N 0.29 -2.55 -1.11 3.49 2.13 0.49 -4.72 120.64 118.65 2di0 n GLU 53 Ca 0.14 0.03 -0.25 0.00 0.66 0.00 0.00 57.16 57.74 2di0 n GLU 53 Cb 0.74 -4.52 0.10 0.00 0.27 0.00 0.00 31.44 28.02 2di0 n GLU 53 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2di0 n ARG 54 N -2.79 2.23 -2.43 5.31 1.74 0.23 -4.94 116.66 116.02 2di0 n ARG 54 Ca 0.02 -2.59 -0.42 0.00 -0.77 0.00 0.00 57.85 54.09 2di0 n ARG 54 Cb 0.49 -2.02 -0.03 0.00 -1.02 0.00 0.00 32.46 29.88 2di0 n ARG 54 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2di0 s LEU 55 N -2.95 4.35 0.74 0.55 1.43 -1.26 -4.80 118.68 116.74 2di0 s LEU 55 Ca 0.50 1.98 -0.16 0.00 -1.03 0.00 0.00 54.13 55.42 2di0 s LEU 55 Cb 0.41 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.99 2di0 s LEU 55 CO 0.03 -0.49 0.26 0.00 0.23 0.00 0.00 176.35 176.38 2di0 n ALA 56 N 4.20 -2.30 1.04 4.21 0.00 -1.26 -4.53 120.51 121.86 2di0 n ALA 56 Ca 0.09 -0.29 0.11 0.00 0.00 0.00 0.00 53.44 53.35 2di0 n ALA 56 Cb 0.46 -1.70 0.56 0.00 0.00 0.00 0.00 19.45 18.77 2di0 n ALA 56 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2di0 n PRO 57 N -0.09 0.28 -0.04 0.00 -0.04 -1.26 -0.03 135.00 133.82 2di0 n PRO 57 Ca 0.08 0.08 -0.04 0.00 -0.04 0.00 0.00 63.50 63.58 2di0 n PRO 57 Cb 0.50 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.33 2di0 n PRO 57 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2di0 n THR 58 N -1.31 1.14 -0.10 0.52 -1.04 -1.26 -3.88 114.28 108.35 2di0 n THR 58 Ca 0.10 -0.75 -0.24 0.00 -2.04 0.00 0.00 64.05 61.12 2di0 n THR 58 Cb 0.19 -0.54 -0.11 0.00 -1.82 0.00 0.00 70.33 68.04 2di0 n THR 58 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2di0 n LEU 59 N -2.75 2.22 -0.06 -4.42 4.77 -1.05 -3.55 117.00 112.16 2di0 n LEU 59 Ca -0.20 0.26 0.24 0.00 -0.03 0.00 0.00 56.01 56.28 2di0 n LEU 59 Cb 0.96 -0.93 0.71 0.00 -2.33 0.00 0.00 43.42 41.83 2di0 n LEU 59 CO 0.44 0.59 1.22 -1.28 -1.33 0.00 0.00 177.39 177.03 2di0 h SER 60 N -0.65 0.00 0.13 -1.43 0.87 -0.67 0.20 113.55 111.99 2di0 h SER 60 Ca -0.53 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 59.73 2di0 h SER 60 Cb 1.64 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 63.63 2di0 h SER 60 CO -0.22 0.00 -1.26 0.06 -0.53 0.00 0.00 176.83 174.88 2di0 h GLN 61 N 0.00 0.62 -6.41 2.24 3.07 -1.73 -3.46 115.11 109.45 2di0 h GLN 61 Ca 0.32 -0.84 -0.51 0.00 0.09 0.00 0.00 58.65 57.70 2di0 h GLN 61 Cb 1.31 0.28 0.23 0.00 0.08 0.00 0.00 27.48 29.39 2di0 h GLN 61 CO -0.00 1.39 -1.44 1.28 0.09 0.00 0.00 178.83 180.15 2di0 n LEU 62 N -3.80 -2.77 -4.62 0.06 4.77 0.71 -4.74 117.00 106.61 2di0 n LEU 62 Ca -0.14 0.12 -0.43 0.00 -0.03 0.00 0.00 56.01 55.53 2di0 n LEU 62 Cb 0.99 -0.90 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 2di0 n LEU 62 CO 0.58 -3.94 1.53 -0.62 -1.33 0.00 0.00 177.39 173.62 2di0 s ASP 63 N -1.52 6.13 0.55 -1.43 -1.08 -1.26 -4.83 116.67 113.22 2di0 s ASP 63 Ca 0.48 1.80 0.27 0.00 -0.52 0.00 0.00 52.55 54.58 2di0 s ASP 63 Cb -0.12 -2.53 1.44 0.00 -1.46 0.00 0.00 42.92 40.26 2di0 s ASP 63 CO 0.71 -1.43 1.99 0.03 0.52 0.00 0.00 175.17 176.98 2di0 h ARG 64 N 11.91 0.00 -1.05 4.34 3.08 -1.88 0.15 114.38 130.92 2di0 h ARG 64 Ca -0.38 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.07 2di0 h ARG 64 Cb 1.19 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 30.86 2di0 h ARG 64 CO 0.99 0.00 -0.23 0.09 -1.07 0.00 0.00 179.97 179.74 2di0 n ASN 65 N -4.21 5.79 -4.70 7.04 5.03 -1.26 -0.62 115.26 122.32 2di0 n ASN 65 Ca 0.09 -3.76 -0.42 0.00 0.87 0.00 0.00 54.58 51.36 2di0 n ASN 65 Cb 0.61 -0.58 -0.03 0.00 -1.02 0.00 0.00 39.78 38.76 2di0 n ASN 65 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2di0 s LEU 66 N -3.69 4.36 0.78 3.41 2.96 0.53 -4.54 118.68 122.49 2di0 s LEU 66 Ca 0.54 2.40 -0.11 0.00 -0.22 0.00 0.00 54.13 56.73 2di0 s LEU 66 Cb 0.43 -3.58 0.07 0.00 0.50 0.00 0.00 46.19 43.61 2di0 s LEU 66 CO -0.05 -0.76 1.15 -0.62 -1.32 0.00 0.00 176.35 174.74 2di0 s ASP 67 N 1.58 4.68 0.05 3.68 2.15 -1.26 -0.05 116.67 127.50 2di0 s ASP 67 Ca 0.68 0.79 0.00 0.00 0.43 0.00 0.00 52.55 54.45 2di0 s ASP 67 Cb -0.38 -1.35 0.00 0.00 -0.30 0.00 0.00 42.92 40.89 2di0 s ASP 67 CO 0.30 -1.78 0.00 0.54 -0.17 0.00 0.00 175.17 174.06 2di0 n ARG 68 N -3.22 0.00 -1.47 4.34 1.74 -1.26 -3.60 116.66 113.18 2di0 n ARG 68 Ca 0.08 0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.71 2di0 n ARG 68 Cb 0.60 -0.45 -0.01 0.00 -1.02 0.00 0.00 32.46 31.58 2di0 n ARG 68 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2di0 n GLU 69 N -3.17 0.60 -4.47 5.56 2.13 -1.26 -4.98 120.64 115.04 2di0 n GLU 69 Ca 0.00 0.21 -0.25 0.00 0.66 0.00 0.00 57.16 57.79 2di0 n GLU 69 Cb 0.26 -1.41 -0.13 0.00 0.27 0.00 0.00 31.44 30.42 2di0 n GLU 69 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 2di0 s MET 70 N -1.34 1.26 0.00 5.31 -1.94 -1.26 -5.16 119.30 116.17 2di0 s MET 70 Ca 0.62 -1.04 0.00 0.00 -1.71 0.00 0.00 55.69 53.56 2di0 s MET 70 Cb -0.75 -1.44 0.00 0.00 2.01 0.00 0.00 34.83 34.65 2di0 s MET 70 CO 0.58 0.35 0.21 0.09 -0.01 0.00 0.00 175.02 176.24