#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 1.27 -0.29 1.61 0.15 -1.26 -4.97 113.70 110.21 2di0 s SER 2 Ca 0.00 -0.01 -0.02 0.00 0.70 0.00 0.00 55.95 56.62 2di0 s SER 2 Cb 0.00 -0.30 0.01 0.00 -1.71 0.00 0.00 66.02 64.02 2di0 s SER 2 CO 0.00 -0.20 0.04 -1.20 1.20 0.00 0.00 173.24 173.08 2di0 n SER 3 N 5.07 -6.82 0.00 5.45 7.64 -1.26 -5.07 113.62 118.64 2di0 n SER 3 Ca -0.08 1.42 0.00 0.00 1.01 0.00 0.00 58.87 61.22 2di0 n SER 3 Cb 0.50 -5.29 0.00 0.00 -1.01 0.00 0.00 64.21 58.41 2di0 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2di0 n GLY 4 N 0.88 1.36 3.38 0.23 0.00 -1.26 -5.19 105.19 104.59 2di0 n GLY 4 Ca -0.07 0.50 -0.10 0.00 0.00 0.00 0.00 46.02 46.35 2di0 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2di0 s SER 5 N 0.00 -0.09 -0.11 1.61 1.04 -1.26 -5.07 113.70 109.81 2di0 s SER 5 Ca 0.00 -0.62 -0.08 0.00 0.48 0.00 0.00 55.95 55.73 2di0 s SER 5 Cb 0.00 0.48 0.03 0.00 0.10 0.00 0.00 66.02 66.63 2di0 s SER 5 CO 0.00 -0.92 0.17 -1.20 0.98 0.00 0.00 173.24 172.27 2di0 n SER 6 N -0.24 -3.46 0.00 7.02 7.64 -1.26 -4.96 113.62 118.36 2di0 n SER 6 Ca -0.11 1.52 0.00 0.00 1.01 0.00 0.00 58.87 61.29 2di0 n SER 6 Cb 0.63 -5.15 0.00 0.00 -1.01 0.00 0.00 64.21 58.68 2di0 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2di0 n GLY 7 N 1.80 0.31 3.57 0.23 0.00 -1.26 -5.01 105.19 104.84 2di0 n GLY 7 Ca -0.28 -0.73 -0.19 0.00 0.00 0.00 0.00 46.02 44.82 2di0 n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2di0 s MET 8 N 0.00 1.76 -0.31 1.61 -2.45 -1.26 -4.29 119.30 114.36 2di0 s MET 8 Ca 0.00 -0.38 0.01 0.00 -1.25 0.00 0.00 55.69 54.07 2di0 s MET 8 Cb 0.00 -5.01 0.31 0.00 1.25 0.00 0.00 34.83 31.38 2di0 s MET 8 CO 0.00 -4.63 1.36 0.00 1.05 0.00 0.00 175.02 172.80 2di0 n GLY 10 N 0.95 -1.94 0.04 0.00 0.00 -1.26 -4.99 105.19 98.00 2di0 n GLY 10 Ca -0.03 0.69 -0.00 0.00 0.00 0.00 0.00 46.02 46.68 2di0 n GLY 10 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2di0 h VAL 11 N 0.00 0.00 -0.98 1.61 2.07 -1.98 -3.27 116.25 113.71 2di0 h VAL 11 Ca 0.00 -0.75 0.15 0.00 0.82 0.00 0.00 66.70 66.92 2di0 h VAL 11 Cb 0.00 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.62 2di0 h VAL 11 CO 0.00 0.00 -0.40 -0.62 0.02 0.00 0.00 177.57 176.57 2di0 n GLU 12 N -4.08 -0.25 -0.27 1.57 4.71 -1.26 -0.06 120.64 121.00 2di0 n GLU 12 Ca -0.00 1.50 -0.12 0.00 -0.01 0.00 0.00 57.16 58.53 2di0 n GLU 12 Cb 0.00 -2.23 -0.10 0.00 -1.01 0.00 0.00 31.44 28.11 2di0 n GLU 12 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 2di0 h LEU 13 N 0.00 -1.96 -0.82 -4.62 6.46 -1.89 0.63 115.31 113.12 2di0 h LEU 13 Ca 0.33 0.28 0.20 0.00 -0.12 0.00 0.00 57.88 58.56 2di0 h LEU 13 Cb 0.57 0.83 -0.13 0.00 -0.73 0.00 0.00 40.66 41.20 2di0 h LEU 13 CO -0.97 -0.31 0.18 -0.78 -0.62 0.00 0.00 178.44 175.94 2di0 h ASP 14 N -0.20 -0.05 -0.62 1.25 1.82 -0.52 0.51 116.42 118.61 2di0 h ASP 14 Ca 0.11 0.18 0.08 0.00 -0.39 0.00 0.00 57.03 57.01 2di0 h ASP 14 Cb 0.49 0.26 -0.11 0.00 0.68 0.00 0.00 39.33 40.65 2di0 h ASP 14 CO -0.74 -0.12 -0.48 -1.28 -1.61 0.00 0.00 179.24 175.01 2di0 h SER 15 N 0.22 -1.67 0.17 2.28 0.87 0.14 0.35 113.55 115.91 2di0 h SER 15 Ca 0.49 0.26 0.01 0.00 -1.23 0.00 0.00 61.79 61.32 2di0 h SER 15 Cb 0.91 0.74 -0.04 0.00 -0.44 0.00 0.00 62.40 63.57 2di0 h SER 15 CO -0.61 -0.33 -0.42 -0.07 -0.53 0.00 0.00 176.83 174.86 2di0 h LEU 16 N -0.22 -1.23 -0.19 2.23 3.38 -0.34 1.43 115.31 120.36 2di0 h LEU 16 Ca 0.16 0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.28 2di0 h LEU 16 Cb 0.55 0.45 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 2di0 h LEU 16 CO -0.72 -0.51 -0.17 0.40 0.09 0.00 0.00 178.44 177.53 2di0 h ILE 17 N -0.69 0.00 -0.15 1.22 2.04 -0.46 0.20 117.51 119.67 2di0 h ILE 17 Ca 0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.92 2di0 h ILE 17 Cb 0.70 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.72 2di0 h ILE 17 CO -0.21 0.00 -0.22 0.77 0.00 0.00 0.00 178.15 178.49 2di0 h SER 18 N -0.07 -0.69 -0.94 1.72 4.64 -0.15 0.20 113.55 118.25 2di0 h SER 18 Ca 0.03 0.12 0.12 0.00 -0.47 0.00 0.00 61.79 61.59 2di0 h SER 18 Cb 0.16 0.31 -0.13 0.00 -0.31 0.00 0.00 62.40 62.43 2di0 h SER 18 CO -0.22 -0.27 -0.45 0.00 -0.87 0.00 0.00 176.83 175.02 2di0 n GLN 19 N -5.36 -0.31 0.22 4.77 1.13 0.49 0.19 117.38 118.50 2di0 n GLN 19 Ca -0.02 1.44 -0.15 0.00 -1.94 0.00 0.00 57.00 56.33 2di0 n GLN 19 Cb 0.27 -2.12 -0.08 0.00 0.11 0.00 0.00 30.24 28.42 2di0 n GLN 19 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2di0 h VAL 20 N 0.00 0.59 -0.69 5.09 2.07 -0.03 -3.09 116.25 120.18 2di0 h VAL 20 Ca 0.25 -0.35 0.11 0.00 0.82 0.00 0.00 66.70 67.52 2di0 h VAL 20 Cb 0.48 0.76 -0.12 0.00 -1.52 0.00 0.00 31.29 30.89 2di0 h VAL 20 CO -0.91 0.06 -0.40 0.50 0.02 0.00 0.00 177.57 176.84 2di0 h LYS 21 N -0.74 -0.14 -1.56 1.57 3.64 0.19 1.69 116.57 121.22 2di0 h LYS 21 Ca -0.05 0.01 0.50 0.00 -1.27 0.00 0.00 60.65 59.83 2di0 h LYS 21 Cb 0.52 0.03 -0.11 0.00 -0.41 0.00 0.00 32.23 32.25 2di0 h LYS 21 CO 0.09 -0.09 1.05 -0.44 -2.27 0.00 0.00 179.45 177.79 2di0 h ASP 22 N -0.15 0.14 0.15 4.20 3.32 0.21 1.80 116.42 126.09 2di0 h ASP 22 Ca 0.23 0.10 -0.36 0.00 0.02 0.00 0.00 57.03 57.02 2di0 h ASP 22 Cb 0.56 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 2di0 h ASP 22 CO -0.76 -0.15 -2.00 0.18 -1.72 0.00 0.00 179.24 174.79 2di0 n LEU 23 N -4.45 2.47 -3.44 1.55 4.77 0.49 -4.56 117.00 113.82 2di0 n LEU 23 Ca 0.41 0.21 -0.26 0.00 -0.03 0.00 0.00 56.01 56.33 2di0 n LEU 23 Cb 1.67 -0.97 -0.09 0.00 -2.33 0.00 0.00 43.42 41.70 2di0 n LEU 23 CO 0.28 0.81 -0.08 0.18 -1.33 0.00 0.00 177.39 177.25 2di0 n LEU 24 N -3.42 2.26 0.14 2.23 4.77 0.49 -4.89 117.00 118.58 2di0 n LEU 24 Ca -0.31 -5.10 0.01 0.00 -0.03 0.00 0.00 56.01 50.58 2di0 n LEU 24 Cb 1.05 -0.21 0.16 0.00 -2.33 0.00 0.00 43.42 42.08 2di0 n LEU 24 CO 0.42 1.99 0.50 1.55 -1.33 0.00 0.00 177.39 180.53 2di0 h PRO 25 N 4.48 0.00 -0.49 3.23 0.13 0.18 -3.26 132.00 136.28 2di0 h PRO 25 Ca 0.16 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.39 2di0 h PRO 25 Cb 0.76 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.79 2di0 h PRO 25 CO 0.67 0.56 -0.27 -0.44 -0.23 0.00 0.00 178.00 178.29 2di0 h ASP 26 N 0.00 -0.94 -3.53 1.44 3.32 -1.90 -3.41 116.42 111.41 2di0 h ASP 26 Ca -0.01 0.19 -0.45 0.00 0.02 0.00 0.00 57.03 56.79 2di0 h ASP 26 Cb 1.18 0.48 0.20 0.00 0.22 0.00 0.00 39.33 41.41 2di0 h ASP 26 CO 0.07 -0.28 0.08 -0.76 -1.72 0.00 0.00 179.24 176.63 2di0 s LEU 27 N -10.68 1.25 -0.08 1.55 1.43 -1.23 -4.83 118.68 106.09 2di0 s LEU 27 Ca -0.14 1.51 -0.05 0.00 -1.03 0.00 0.00 54.13 54.41 2di0 s LEU 27 Cb 0.15 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.79 2di0 s LEU 27 CO 0.70 -3.80 0.14 -0.83 0.23 0.00 0.00 176.35 172.78 2di0 s GLY 28 N -2.78 2.14 0.22 -3.19 0.00 -0.18 -4.90 107.32 98.62 2di0 s GLY 28 Ca 0.67 -0.70 -0.16 0.00 0.00 0.00 0.00 44.72 44.54 2di0 s GLY 28 CO 0.62 -0.49 1.59 0.83 0.00 0.00 0.00 173.10 175.65 2di0 h GLU 29 N 4.60 -0.06 -1.00 2.90 5.08 -1.81 0.39 114.58 124.68 2di0 h GLU 29 Ca -0.53 0.00 0.33 0.00 -1.00 0.00 0.00 59.36 58.16 2di0 h GLU 29 Cb 1.21 0.01 -0.18 0.00 0.50 0.00 0.00 28.75 30.29 2di0 h GLU 29 CO 0.61 -0.04 0.21 0.78 -1.00 0.00 0.00 179.01 179.57 2di0 h GLY 30 N -0.07 1.62 1.93 -3.84 0.00 -0.37 1.92 103.07 104.26 2di0 h GLY 30 Ca 0.31 0.05 -0.22 0.00 0.00 0.00 0.00 47.33 47.48 2di0 h GLY 30 CO -0.77 -0.63 -1.02 -2.75 0.00 0.00 0.00 176.54 171.38 2di0 h PHE 31 N 0.00 0.10 -0.22 5.60 3.57 -0.26 -2.43 116.94 123.30 2di0 h PHE 31 Ca 0.69 -0.07 -0.15 0.00 3.53 0.00 0.00 57.97 61.97 2di0 h PHE 31 Cb 1.61 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 40.34 2di0 h PHE 31 CO -0.33 1.03 -0.49 0.82 -2.23 0.00 0.00 178.31 177.11 2di0 h ILE 32 N 0.02 1.31 0.18 1.41 2.04 0.42 -2.05 117.51 120.83 2di0 h ILE 32 Ca -0.03 -1.70 -0.01 0.00 1.00 0.00 0.00 64.86 64.12 2di0 h ILE 32 Cb 1.76 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.51 2di0 h ILE 32 CO 0.14 0.53 -0.09 0.25 0.00 0.00 0.00 178.15 178.99 2di0 h LEU 33 N 0.46 -0.20 -0.35 1.44 7.12 0.21 -2.18 115.31 121.82 2di0 h LEU 33 Ca 0.02 -0.31 0.07 0.00 0.13 0.00 0.00 57.88 57.79 2di0 h LEU 33 Cb 1.02 0.05 -0.09 0.00 -0.53 0.00 0.00 40.66 41.12 2di0 h LEU 33 CO 0.09 0.26 -0.40 0.00 -0.13 0.00 0.00 178.44 178.26 2di0 h ALA 34 N -0.05 -0.40 -0.09 1.25 0.00 -1.44 0.22 119.26 118.75 2di0 h ALA 34 Ca -0.02 0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2di0 h ALA 34 Cb 0.50 0.82 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 2di0 h ALA 34 CO 0.04 -0.84 -0.28 0.00 0.00 0.00 0.00 179.25 178.17 2di0 h LEU 36 N -0.28 -1.11 -0.88 0.00 3.38 -0.67 1.59 115.31 117.33 2di0 h LEU 36 Ca 0.02 0.17 0.08 0.00 0.09 0.00 0.00 57.88 58.24 2di0 h LEU 36 Cb 0.34 0.49 -0.11 0.00 0.09 0.00 0.00 40.66 41.48 2di0 h LEU 36 CO -0.24 -0.12 -0.52 -0.62 0.09 0.00 0.00 178.44 177.04 2di0 n GLU 37 N -4.15 -0.39 -0.32 1.13 1.02 0.71 0.16 120.64 118.80 2di0 n GLU 37 Ca 0.01 1.38 -0.01 0.00 -0.02 0.00 0.00 57.16 58.52 2di0 n GLU 37 Cb 0.13 -2.03 0.16 0.00 -0.02 0.00 0.00 31.44 29.69 2di0 n GLU 37 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 2di0 h TYR 38 N 0.00 1.15 -0.67 -0.32 5.03 0.12 -2.53 116.97 119.75 2di0 h TYR 38 Ca 0.14 0.03 -0.37 0.00 2.58 0.00 0.00 58.73 61.11 2di0 h TYR 38 Cb 0.36 -0.39 -0.14 0.00 1.55 0.00 0.00 36.73 38.11 2di0 h TYR 38 CO -0.95 0.72 0.23 0.66 -1.32 0.00 0.00 178.16 177.50 2di0 n TYR 39 N -4.40 1.20 -4.11 -3.82 4.01 0.52 -4.78 117.16 105.79 2di0 n TYR 39 Ca 0.11 -1.82 -0.31 0.00 -0.16 0.00 0.00 57.90 55.72 2di0 n TYR 39 Cb 0.02 -1.27 -0.06 0.00 -0.31 0.00 0.00 39.34 37.72 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 1.08 -1.14 -4.06 -0.72 8.25 -0.71 0.29 115.22 118.20 2di0 n HIS 40 Ca 0.41 0.43 -0.38 0.00 -0.26 0.00 0.00 57.72 57.91 2di0 n HIS 40 Cb 0.62 -2.49 -0.01 0.00 1.12 0.00 0.00 29.99 29.24 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 -4.31 -1.16 -4.77 4.41 4.01 0.42 -4.93 117.16 110.84 2di0 n TYR 41 Ca -0.25 0.17 -0.28 0.00 -0.16 0.00 0.00 57.90 57.38 2di0 n TYR 41 Cb 0.60 -2.41 -0.17 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 -3.85 2.41 -0.07 7.72 -1.08 0.14 -4.97 116.67 116.97 2di0 s ASP 42 Ca 0.32 -0.42 -0.18 0.00 -0.52 0.00 0.00 52.55 51.74 2di0 s ASP 42 Cb -0.18 -1.10 -0.14 0.00 -1.46 0.00 0.00 42.92 40.04 2di0 s ASP 42 CO 0.86 0.07 0.69 1.55 0.52 0.00 0.00 175.17 178.87 2di0 h PRO 43 N 7.00 -0.17 -0.86 4.34 0.13 -1.91 -3.04 132.00 137.48 2di0 h PRO 43 Ca -0.27 0.01 0.23 0.00 -0.87 0.00 0.00 66.00 65.10 2di0 h PRO 43 Cb 1.20 0.04 -0.14 0.00 0.13 0.00 0.00 31.00 32.23 2di0 h PRO 43 CO 0.48 0.24 0.17 0.93 -0.23 0.00 0.00 178.00 179.58 2di0 h GLU 44 N -0.93 0.16 0.62 0.86 5.08 -1.97 0.44 114.58 118.84 2di0 h GLU 44 Ca -0.02 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 2di0 h GLU 44 Cb 0.50 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2di0 h GLU 44 CO 0.03 0.10 -0.49 1.96 -1.00 0.00 0.00 179.01 179.61 2di0 h GLN 45 N 0.16 -1.04 -0.09 2.33 4.20 -1.92 0.58 115.11 119.34 2di0 h GLN 45 Ca 0.53 0.07 0.02 0.00 0.06 0.00 0.00 58.65 59.33 2di0 h GLN 45 Cb 1.05 0.24 -0.03 0.00 0.30 0.00 0.00 27.48 29.03 2di0 h GLN 45 CO -0.69 -0.70 -0.26 0.28 -0.67 0.00 0.00 178.83 176.79 2di0 h VAL 46 N -1.08 0.00 -0.22 -0.54 2.07 -0.93 0.55 116.25 116.10 2di0 h VAL 46 Ca -0.08 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.47 2di0 h VAL 46 Cb 0.91 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 2di0 h VAL 46 CO 0.01 0.00 -0.34 0.40 0.02 0.00 0.00 177.57 177.66 2di0 h ILE 47 N -0.27 0.00 -0.79 4.57 2.04 -0.94 0.44 117.51 122.57 2di0 h ILE 47 Ca 0.02 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.95 2di0 h ILE 47 Cb 0.32 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.31 2di0 h ILE 47 CO -0.22 0.00 -0.47 0.78 0.00 0.00 0.00 178.15 178.24 2di0 h ASN 48 N -0.26 -1.73 -0.21 1.72 2.35 0.57 1.42 115.58 119.43 2di0 h ASN 48 Ca 0.04 0.26 0.03 0.00 -0.55 0.00 0.00 56.30 56.08 2di0 h ASN 48 Cb 0.37 0.76 -0.06 0.00 0.05 0.00 0.00 38.32 39.45 2di0 h ASN 48 CO -0.35 -0.19 -0.44 0.78 -1.65 0.00 0.00 177.43 175.59 2di0 h ASN 49 N -0.01 -1.42 -0.35 5.81 2.35 0.10 0.89 115.58 122.95 2di0 h ASN 49 Ca 0.13 0.18 0.06 0.00 -0.55 0.00 0.00 56.30 56.11 2di0 h ASN 49 Cb 0.33 0.57 -0.08 0.00 0.05 0.00 0.00 38.32 39.19 2di0 h ASN 49 CO -0.74 -0.35 -0.47 0.40 -1.65 0.00 0.00 177.43 174.61 2di0 h ILE 50 N -0.39 0.07 -0.69 2.81 2.04 0.19 1.66 117.51 123.22 2di0 h ILE 50 Ca 0.04 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.05 2di0 h ILE 50 Cb 0.50 0.07 -0.11 0.00 -0.74 0.00 0.00 36.82 36.54 2di0 h ILE 50 CO -0.41 0.00 0.04 -0.07 0.00 0.00 0.00 178.15 177.72 2di0 h LEU 51 N -0.39 -0.23 -1.95 1.44 3.38 0.28 1.42 115.31 119.27 2di0 h LEU 51 Ca 0.11 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2di0 h LEU 51 Cb 0.60 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.63 2di0 h LEU 51 CO -0.55 -0.12 0.00 -0.62 0.09 0.00 0.00 178.44 177.25 2di0 n GLU 52 N -5.27 2.54 -4.27 1.13 -0.58 0.30 -4.87 120.64 109.62 2di0 n GLU 52 Ca 0.12 -1.36 -0.39 0.00 -0.42 0.00 0.00 57.16 55.11 2di0 n GLU 52 Cb 0.41 -1.72 -0.07 0.00 -0.57 0.00 0.00 31.44 29.49 2di0 n GLU 52 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2di0 n GLU 53 N 0.31 -0.82 -1.06 3.49 -0.58 0.49 -4.74 120.64 117.74 2di0 n GLU 53 Ca 0.12 0.13 -0.12 0.00 -0.42 0.00 0.00 57.16 56.86 2di0 n GLU 53 Cb 0.59 -4.41 0.24 0.00 -0.57 0.00 0.00 31.44 27.30 2di0 n GLU 53 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2di0 n ARG 54 N -3.77 2.87 -1.97 3.49 1.74 0.29 -4.94 116.66 114.37 2di0 n ARG 54 Ca 0.11 -3.06 -0.42 0.00 -0.77 0.00 0.00 57.85 53.70 2di0 n ARG 54 Cb 0.42 -2.14 -0.03 0.00 -1.02 0.00 0.00 32.46 29.70 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 -3.15 4.35 1.04 0.55 1.43 -1.26 -4.85 118.68 116.80 2di0 s LEU 55 Ca 0.54 2.41 -0.22 0.00 -1.03 0.00 0.00 54.13 55.82 2di0 s LEU 55 Cb 0.45 -3.56 -0.07 0.00 0.03 0.00 0.00 46.19 43.04 2di0 s LEU 55 CO 0.11 -0.88 -0.79 0.00 0.23 0.00 0.00 176.35 175.01 2di0 n ALA 56 N 5.88 -4.99 0.00 4.21 0.00 -1.26 -4.52 120.51 119.82 2di0 n ALA 56 Ca 0.16 -1.23 -0.18 0.00 0.00 0.00 0.00 53.44 52.19 2di0 n ALA 56 Cb 0.41 -1.16 -0.10 0.00 0.00 0.00 0.00 19.45 18.61 2di0 n ALA 56 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2di0 h PRO 57 N -1.42 0.53 -0.13 0.00 0.13 -1.97 0.89 132.00 130.03 2di0 h PRO 57 Ca -0.45 -0.52 -0.01 0.00 -0.87 0.00 0.00 66.00 64.16 2di0 h PRO 57 Cb 1.37 0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.62 2di0 h PRO 57 CO 0.28 1.15 0.06 1.15 -0.23 0.00 0.00 178.00 180.41 2di0 h THR 58 N 0.11 1.13 -0.16 1.56 2.02 -1.99 -0.18 112.91 115.39 2di0 h THR 58 Ca -0.07 -0.37 -0.03 0.00 0.77 0.00 0.00 66.41 66.70 2di0 h THR 58 Cb 1.35 1.13 -0.00 0.00 -1.74 0.00 0.00 68.15 68.89 2di0 h THR 58 CO 0.14 0.12 -0.03 -0.07 0.37 0.00 0.00 175.52 176.04 2di0 h LEU 59 N 0.08 0.30 -2.01 2.58 3.38 -1.91 -2.46 115.31 115.26 2di0 h LEU 59 Ca 0.05 -0.36 0.15 0.00 0.09 0.00 0.00 57.88 57.80 2di0 h LEU 59 Cb 0.13 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2di0 h LEU 59 CO -0.01 0.59 0.40 -1.28 0.09 0.00 0.00 178.44 178.23 2di0 h SER 60 N 0.00 0.00 -0.19 -0.43 0.87 -0.70 0.13 113.55 113.23 2di0 h SER 60 Ca 0.04 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.43 2di0 h SER 60 Cb 0.46 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.43 2di0 h SER 60 CO 0.01 0.00 -0.56 1.56 -0.53 0.00 0.00 176.83 177.32 2di0 h GLN 61 N 0.00 0.72 -6.48 2.24 1.08 -0.59 -3.45 115.11 108.64 2di0 h GLN 61 Ca 0.24 -0.52 -0.61 0.00 -1.45 0.00 0.00 58.65 56.32 2di0 h GLN 61 Cb 1.03 0.08 0.07 0.00 -0.05 0.00 0.00 27.48 28.62 2di0 h GLN 61 CO -0.00 1.14 0.55 1.28 -0.95 0.00 0.00 178.83 180.84 2di0 n LEU 62 N -4.10 2.57 -4.58 1.46 4.77 0.47 -4.76 117.00 112.84 2di0 n LEU 62 Ca -0.06 1.13 -0.58 0.00 -0.03 0.00 0.00 56.01 56.46 2di0 n LEU 62 Cb 0.63 -1.35 -0.08 0.00 -2.33 0.00 0.00 43.42 40.29 2di0 n LEU 62 CO 0.49 -0.70 0.81 -0.67 -1.33 0.00 0.00 177.39 175.99 2di0 n ASP 63 N 2.40 0.83 -0.29 -1.43 2.03 -1.26 -4.81 116.55 114.01 2di0 n ASP 63 Ca 0.14 1.15 -0.01 0.00 0.52 0.00 0.00 54.79 56.58 2di0 n ASP 63 Cb 0.28 -1.01 0.11 0.00 -0.72 0.00 0.00 41.12 39.78 2di0 n ASP 63 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 2di0 h ARG 64 N 4.09 0.96 -2.00 -0.67 3.08 -1.88 -2.39 114.38 115.57 2di0 h ARG 64 Ca -0.49 -0.06 -0.75 0.00 0.07 0.00 0.00 59.98 58.76 2di0 h ARG 64 Cb 1.39 -0.22 -0.30 0.00 0.08 0.00 0.00 29.97 30.92 2di0 h ARG 64 CO 0.76 0.64 0.74 0.27 -1.07 0.00 0.00 179.97 181.31 2di0 n ASN 65 N -4.60 6.98 -4.75 7.04 6.94 -1.26 -1.01 115.26 124.60 2di0 n ASN 65 Ca 0.10 -3.79 -0.40 0.00 -0.02 0.00 0.00 54.58 50.47 2di0 n ASN 65 Cb 0.11 -0.98 -0.05 0.00 -2.36 0.00 0.00 39.78 36.49 2di0 n ASN 65 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2di0 s LEU 66 N -4.03 4.62 0.40 -4.53 2.96 -0.90 -4.58 118.68 112.62 2di0 s LEU 66 Ca 0.49 2.04 0.08 0.00 -0.22 0.00 0.00 54.13 56.52 2di0 s LEU 66 Cb 0.38 -3.61 -0.00 0.00 0.50 0.00 0.00 46.19 43.45 2di0 s LEU 66 CO -0.32 0.06 0.50 -0.62 -1.32 0.00 0.00 176.35 174.66 2di0 s ASP 67 N -1.07 5.57 -0.19 3.68 2.15 -1.26 0.21 116.67 125.76 2di0 s ASP 67 Ca 0.42 -0.45 -0.13 0.00 0.43 0.00 0.00 52.55 52.82 2di0 s ASP 67 Cb -0.28 -0.74 -0.08 0.00 -0.30 0.00 0.00 42.92 41.52 2di0 s ASP 67 CO 0.35 -0.67 -0.30 0.54 -0.17 0.00 0.00 175.17 174.92 2di0 n ARG 68 N -1.74 0.47 -3.88 4.34 1.74 -1.26 -3.98 116.66 112.35 2di0 n ARG 68 Ca 0.05 0.20 -0.35 0.00 -0.77 0.00 0.00 57.85 56.98 2di0 n ARG 68 Cb 0.59 -1.30 -0.14 0.00 -1.02 0.00 0.00 32.46 30.60 2di0 n ARG 68 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2di0 s GLU 69 N -2.58 2.54 -0.70 5.56 2.12 -1.26 -5.02 118.70 119.36 2di0 s GLU 69 Ca -0.29 -1.20 0.05 0.00 0.36 0.00 0.00 54.97 53.89 2di0 s GLU 69 Cb 0.08 -3.21 0.25 0.00 0.26 0.00 0.00 34.13 31.52 2di0 s GLU 69 CO 0.39 -0.59 0.82 -0.12 -0.54 0.00 0.00 175.26 175.22 2di0 n MET 70 N 4.67 2.74 -0.01 4.30 1.56 -1.26 -5.19 117.12 123.92 2di0 n MET 70 Ca -0.14 -4.66 0.00 0.00 -0.27 0.00 0.00 57.70 52.64 2di0 n MET 70 Cb 0.44 -2.29 0.00 0.00 2.15 0.00 0.00 33.22 33.52 2di0 n MET 70 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53