#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k39 s GLN 2 N 0.00 4.22 0.14 2.12 -0.21 -1.26 -1.26 119.66 123.41 2k39 s GLN 2 Ca 0.00 1.25 0.01 0.00 0.02 0.00 0.00 55.36 56.64 2k39 s GLN 2 Cb 0.00 -2.33 -0.04 0.00 1.00 0.00 0.00 33.01 31.63 2k39 s GLN 2 CO 0.00 -0.05 0.01 0.96 -2.12 0.00 0.00 175.29 174.09 2k39 s ILE 3 N -1.97 0.48 0.14 1.08 -4.36 -1.20 -2.23 121.20 113.14 2k39 s ILE 3 Ca 0.60 -1.94 0.10 0.00 -0.26 0.00 0.00 60.65 59.15 2k39 s ILE 3 Cb -0.14 -1.99 -0.04 0.00 1.25 0.00 0.00 42.46 41.54 2k39 s ILE 3 CO 0.18 -0.57 -0.24 -0.36 0.24 0.00 0.00 174.94 174.19 2k39 s PHE 4 N -3.79 2.16 -0.07 1.37 0.08 -0.02 -2.62 117.98 115.08 2k39 s PHE 4 Ca 0.21 -0.39 0.03 0.00 0.12 0.00 0.00 56.93 56.89 2k39 s PHE 4 Cb 0.07 -1.14 0.01 0.00 -0.57 0.00 0.00 43.02 41.38 2k39 s PHE 4 CO 0.01 0.34 -0.14 0.08 -0.10 0.00 0.00 175.22 175.41 2k39 s VAL 5 N -1.27 1.31 0.66 -0.44 1.01 0.01 -0.71 120.40 120.96 2k39 s VAL 5 Ca 0.14 -0.58 -0.06 0.00 0.00 0.00 0.00 61.98 61.47 2k39 s VAL 5 Cb -0.09 -1.18 0.04 0.00 0.00 0.00 0.00 36.38 35.15 2k39 s VAL 5 CO 0.06 0.39 0.97 -0.54 0.00 0.00 0.00 175.10 175.98 2k39 s LYS 6 N 0.60 2.51 0.44 2.72 1.02 0.37 0.28 119.74 127.68 2k39 s LYS 6 Ca -0.15 -0.14 0.03 0.00 0.02 0.00 0.00 55.97 55.72 2k39 s LYS 6 Cb -0.16 -2.21 -0.03 0.00 -0.52 0.00 0.00 37.83 34.91 2k39 s LYS 6 CO 0.05 -1.01 0.08 0.95 -0.92 0.00 0.00 175.35 174.50 2k39 s THR 7 N -3.14 0.89 0.31 2.17 -4.23 -1.09 -1.86 115.64 108.69 2k39 s THR 7 Ca 0.58 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.12 2k39 s THR 7 Cb -0.11 -2.35 0.11 0.00 1.34 0.00 0.00 72.50 71.49 2k39 s THR 7 CO 0.45 0.00 1.79 0.25 -0.54 0.00 0.00 174.62 176.57 2k39 h LEU 8 N 1.66 0.47 0.06 4.79 7.12 -1.84 -2.98 115.31 124.59 2k39 h LEU 8 Ca -0.39 -0.13 -0.00 0.00 0.13 0.00 0.00 57.88 57.49 2k39 h LEU 8 Cb 1.28 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 41.29 2k39 h LEU 8 CO 0.65 0.65 -0.03 0.71 -0.13 0.00 0.00 178.44 180.28 2k39 h THR 9 N 0.45 1.05 0.00 1.05 1.35 -1.97 -3.49 112.91 111.35 2k39 h THR 9 Ca 0.08 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 2k39 h THR 9 Cb 0.52 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 2k39 h THR 9 CO 0.03 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 176.00 2k39 n GLY 10 N -0.68 1.56 3.74 5.82 0.00 -1.13 -5.12 105.19 109.38 2k39 n GLY 10 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 2k39 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k39 s LYS 11 N -0.11 4.39 0.09 1.61 2.20 -1.26 -4.55 119.74 122.11 2k39 s LYS 11 Ca 0.00 2.07 -0.19 0.00 -0.36 0.00 0.00 55.97 57.50 2k39 s LYS 11 Cb 0.00 -3.17 -0.07 0.00 -1.51 0.00 0.00 37.83 33.08 2k39 s LYS 11 CO 0.00 -0.23 0.57 0.99 -0.36 0.00 0.00 175.35 176.32 2k39 s THR 12 N -0.11 4.75 0.10 3.43 2.01 -1.26 -2.67 115.64 121.88 2k39 s THR 12 Ca 0.55 1.17 0.09 0.00 0.31 0.00 0.00 61.69 63.81 2k39 s THR 12 Cb -0.37 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 2k39 s THR 12 CO 0.40 0.50 -0.19 -0.63 -0.69 0.00 0.00 174.62 174.02 2k39 s ILE 13 N -1.17 2.78 -0.01 1.82 1.01 0.14 -5.00 121.20 120.77 2k39 s ILE 13 Ca 0.31 -1.46 0.02 0.00 0.00 0.00 0.00 60.65 59.52 2k39 s ILE 13 Cb -0.19 -2.25 -0.00 0.00 0.01 0.00 0.00 42.46 40.03 2k39 s ILE 13 CO 0.19 0.15 -0.07 0.28 0.00 0.00 0.00 174.94 175.49 2k39 s THR 14 N -1.09 0.55 0.07 2.92 -1.32 -1.26 -0.81 115.64 114.70 2k39 s THR 14 Ca 0.17 -0.29 -0.03 0.00 -1.21 0.00 0.00 61.69 60.33 2k39 s THR 14 Cb -0.10 -0.47 -0.03 0.00 -1.51 0.00 0.00 72.50 70.39 2k39 s THR 14 CO 0.09 0.16 0.04 -0.76 -2.21 0.00 0.00 174.62 171.93 2k39 s LEU 15 N -0.12 2.11 -0.17 9.08 1.43 -1.08 -5.01 118.68 124.92 2k39 s LEU 15 Ca 0.02 -0.95 -0.04 0.00 -1.03 0.00 0.00 54.13 52.13 2k39 s LEU 15 Cb -0.03 0.42 -0.02 0.00 0.03 0.00 0.00 46.19 46.59 2k39 s LEU 15 CO -0.00 -0.66 -0.04 -1.61 0.23 0.00 0.00 176.35 174.27 2k39 s GLU 16 N -3.93 3.58 0.34 1.70 8.01 -1.26 -3.21 118.70 123.93 2k39 s GLU 16 Ca 0.09 -0.55 0.05 0.00 0.01 0.00 0.00 54.97 54.57 2k39 s GLU 16 Cb 0.07 -2.94 -0.02 0.00 -4.31 0.00 0.00 34.13 26.93 2k39 s GLU 16 CO -0.08 0.11 0.18 1.33 0.01 0.00 0.00 175.26 176.81 2k39 n VAL 17 N 3.91 0.00 -4.21 2.63 0.24 -0.39 -4.95 118.33 115.56 2k39 n VAL 17 Ca -0.17 -2.16 -0.18 0.00 -2.04 0.00 0.00 64.34 59.78 2k39 n VAL 17 Cb 0.52 0.91 -0.12 0.00 -1.47 0.00 0.00 33.84 33.67 2k39 n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2k39 s GLU 18 N -3.32 0.82 0.27 7.34 2.02 -1.26 -0.42 118.70 124.15 2k39 s GLU 18 Ca 0.26 -0.88 0.00 0.00 0.02 0.00 0.00 54.97 54.36 2k39 s GLU 18 Cb 0.01 -0.82 0.61 0.00 0.10 0.00 0.00 34.13 34.04 2k39 s GLU 18 CO 0.18 0.19 1.69 -1.35 0.02 0.00 0.00 175.26 175.99 2k39 h PRO 19 N 4.48 0.34 -0.20 0.39 0.11 -1.99 -1.32 132.00 133.81 2k39 h PRO 19 Ca -0.40 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2k39 h PRO 19 Cb 1.19 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2k39 h PRO 19 CO 0.41 0.23 0.00 0.45 -0.21 0.00 0.00 178.00 178.88 2k39 n SER 20 N -5.09 1.21 -4.72 -2.05 2.88 -1.26 -1.72 113.62 102.86 2k39 n SER 20 Ca 0.19 -1.90 -0.34 0.00 -1.33 0.00 0.00 58.87 55.49 2k39 n SER 20 Cb 0.57 -0.13 0.09 0.00 -0.75 0.00 0.00 64.21 63.99 2k39 n SER 20 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2k39 s ASP 21 N -1.15 4.25 0.19 -3.46 1.01 -0.50 -4.76 116.67 112.26 2k39 s ASP 21 Ca 0.20 2.33 -0.08 0.00 0.71 0.00 0.00 52.55 55.71 2k39 s ASP 21 Cb 0.10 -2.59 -0.07 0.00 1.01 0.00 0.00 42.92 41.38 2k39 s ASP 21 CO 0.14 -2.22 0.48 0.42 0.21 0.00 0.00 175.17 174.20 2k39 s THR 22 N -2.01 5.02 0.29 -1.27 -4.23 -1.26 -3.02 115.64 109.16 2k39 s THR 22 Ca 0.74 0.33 0.03 0.00 -1.18 0.00 0.00 61.69 61.61 2k39 s THR 22 Cb -0.29 -3.62 0.31 0.00 1.34 0.00 0.00 72.50 70.24 2k39 s THR 22 CO 0.45 -0.00 1.65 0.40 -0.54 0.00 0.00 174.62 176.58 2k39 h ILE 23 N 2.09 0.32 -0.21 2.99 1.08 -1.85 -2.52 117.51 119.41 2k39 h ILE 23 Ca -0.47 -0.08 0.06 0.00 -0.39 0.00 0.00 64.86 63.98 2k39 h ILE 23 Cb 1.17 0.07 -0.07 0.00 -3.07 0.00 0.00 36.82 34.93 2k39 h ILE 23 CO 0.70 0.04 -0.28 -0.08 -0.69 0.00 0.00 178.15 177.84 2k39 h GLU 24 N 0.23 -0.29 -0.03 2.37 4.81 -1.94 -2.38 114.58 117.34 2k39 h GLU 24 Ca 0.57 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.78 2k39 h GLU 24 Cb 1.15 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 2k39 h GLU 24 CO -0.65 -0.20 -0.16 -0.97 -0.73 0.00 0.00 179.01 176.31 2k39 h ASN 25 N -0.30 0.04 -0.34 1.04 -0.73 -1.85 -0.12 115.58 113.30 2k39 h ASN 25 Ca 0.12 -0.01 -0.17 0.00 1.87 0.00 0.00 56.30 58.11 2k39 h ASN 25 Cb 0.50 -0.01 -0.00 0.00 0.27 0.00 0.00 38.32 39.07 2k39 h ASN 25 CO -0.39 0.21 -0.46 0.58 -0.37 0.00 0.00 177.43 177.00 2k39 h VAL 26 N 0.04 1.27 0.00 2.57 2.07 -1.54 -3.27 116.25 117.40 2k39 h VAL 26 Ca 0.01 -1.64 -0.08 0.00 0.82 0.00 0.00 66.70 65.82 2k39 h VAL 26 Cb 0.32 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 2k39 h VAL 26 CO 0.02 0.54 -0.36 0.11 0.02 0.00 0.00 177.57 177.91 2k39 h LYS 27 N 0.73 0.00 -0.05 1.57 1.57 -0.51 -0.03 116.57 119.85 2k39 h LYS 27 Ca 0.04 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.68 2k39 h LYS 27 Cb 1.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.36 2k39 h LYS 27 CO 0.11 0.36 -0.59 0.00 -0.57 0.00 0.00 179.45 178.75 2k39 h ALA 28 N 1.64 0.91 -0.05 3.86 0.00 -1.48 -1.86 119.26 122.28 2k39 h ALA 28 Ca -0.00 -0.54 -0.23 0.00 0.00 0.00 0.00 54.91 54.14 2k39 h ALA 28 Cb 0.73 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.44 2k39 h ALA 28 CO 0.05 0.73 -0.86 0.87 0.00 0.00 0.00 179.25 180.03 2k39 h LYS 29 N 0.12 0.67 0.00 0.00 1.57 -1.12 -1.80 116.57 116.01 2k39 h LYS 29 Ca -0.01 -0.65 -0.04 0.00 -1.87 0.00 0.00 60.65 58.08 2k39 h LYS 29 Cb 1.08 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.55 2k39 h LYS 29 CO 0.09 1.25 -0.21 0.82 -0.57 0.00 0.00 179.45 180.83 2k39 h ILE 30 N 0.33 1.05 -0.46 1.86 2.04 -1.07 -2.34 117.51 118.92 2k39 h ILE 30 Ca -0.09 -0.75 -0.02 0.00 1.00 0.00 0.00 64.86 64.99 2k39 h ILE 30 Cb 1.52 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 39.00 2k39 h ILE 30 CO 0.17 0.21 0.22 -0.61 0.00 0.00 0.00 178.15 178.14 2k39 h GLN 31 N 0.00 0.66 0.00 2.37 4.15 -1.10 0.76 115.11 121.96 2k39 h GLN 31 Ca -0.00 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.32 2k39 h GLN 31 Cb 0.40 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.97 2k39 h GLN 31 CO 0.03 0.57 0.00 0.22 -1.93 0.00 0.00 178.83 177.72 2k39 h ASP 32 N 0.60 0.00 0.00 -0.69 3.58 -0.78 -0.41 116.42 118.72 2k39 h ASP 32 Ca 0.16 0.00 -0.19 0.00 0.42 0.00 0.00 57.03 57.42 2k39 h ASP 32 Cb 0.12 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.15 2k39 h ASP 32 CO -0.02 0.00 -1.49 0.29 -2.88 0.00 0.00 179.24 175.14 2k39 n LYS 33 N -2.54 0.35 0.00 0.28 4.01 -1.10 -4.79 118.16 114.37 2k39 n LYS 33 Ca 0.02 0.15 0.04 0.00 -0.51 0.00 0.00 58.31 58.01 2k39 n LYS 33 Cb 0.31 -1.09 -0.04 0.00 -0.51 0.00 0.00 35.03 33.70 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2k39 n GLU 34 N -3.88 4.23 -2.98 1.97 -0.58 0.25 -5.03 120.64 114.62 2k39 n GLU 34 Ca -0.25 -0.07 -0.12 0.00 -0.42 0.00 0.00 57.16 56.31 2k39 n GLU 34 Cb 0.59 -0.87 0.04 0.00 -0.57 0.00 0.00 31.44 30.62 2k39 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k39 n GLY 35 N 1.13 0.20 3.56 0.62 0.00 -0.16 -4.98 105.19 105.56 2k39 n GLY 35 Ca 0.02 -0.24 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 2k39 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k39 s ILE 36 N -3.11 5.14 0.46 -0.61 1.01 -1.26 -4.96 121.20 117.87 2k39 s ILE 36 Ca 0.27 0.22 -0.23 0.00 0.00 0.00 0.00 60.65 60.91 2k39 s ILE 36 Cb -0.12 -3.82 -0.07 0.00 0.01 0.00 0.00 42.46 38.46 2k39 s ILE 36 CO 0.33 -0.06 1.19 -2.16 0.00 0.00 0.00 174.94 174.25 2k39 s PRO 37 N 2.10 3.74 0.51 2.79 0.04 -1.26 -4.13 135.00 138.79 2k39 s PRO 37 Ca 0.14 1.85 0.30 0.00 0.04 0.00 0.00 61.00 63.33 2k39 s PRO 37 Cb -0.16 -2.44 1.18 0.00 0.04 0.00 0.00 34.50 33.12 2k39 s PRO 37 CO 0.12 -0.59 1.92 -1.00 0.04 0.00 0.00 177.00 177.49 2k39 h PRO 38 N 2.09 0.00 0.01 0.56 0.13 -1.92 -2.89 132.00 129.98 2k39 h PRO 38 Ca -0.49 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.33 2k39 h PRO 38 Cb 1.25 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.33 2k39 h PRO 38 CO 0.60 0.08 -1.82 -3.47 -0.23 0.00 0.00 178.00 173.16 2k39 n ASP 39 N -3.20 0.89 -0.01 1.44 2.03 -1.26 -3.83 116.55 112.60 2k39 n ASP 39 Ca 0.01 0.34 -0.10 0.00 0.52 0.00 0.00 54.79 55.55 2k39 n ASP 39 Cb 0.35 -0.01 0.04 0.00 -0.72 0.00 0.00 41.12 40.78 2k39 n ASP 39 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 2k39 h GLN 40 N 0.01 0.63 -6.46 -0.67 1.08 -1.96 -3.45 115.11 104.28 2k39 h GLN 40 Ca -0.33 -0.39 -0.53 0.00 -1.45 0.00 0.00 58.65 55.94 2k39 h GLN 40 Cb 2.04 0.04 0.03 0.00 -0.05 0.00 0.00 27.48 29.54 2k39 h GLN 40 CO 0.07 1.01 1.03 -1.14 -0.95 0.00 0.00 178.83 178.85 2k39 s GLN 41 N -4.04 4.18 -0.11 1.46 0.74 -1.09 0.13 119.66 120.93 2k39 s GLN 41 Ca -0.08 2.39 0.00 0.00 0.05 0.00 0.00 55.36 57.73 2k39 s GLN 41 Cb 0.11 -3.61 0.02 0.00 1.10 0.00 0.00 33.01 30.64 2k39 s GLN 41 CO 0.85 -0.76 -0.10 0.50 -0.55 0.00 0.00 175.29 175.23 2k39 s ARG 42 N 2.69 1.72 -0.14 1.67 3.52 0.16 -4.91 118.95 123.66 2k39 s ARG 42 Ca 0.76 -0.34 -0.13 0.00 -0.13 0.00 0.00 55.73 55.89 2k39 s ARG 42 Cb -0.41 -1.67 -0.05 0.00 -1.56 0.00 0.00 34.95 31.26 2k39 s ARG 42 CO 0.33 -0.22 0.28 -0.51 -0.81 0.00 0.00 175.30 174.37 2k39 s LEU 43 N 1.51 4.29 0.29 -0.88 2.01 -1.26 -0.70 118.68 123.95 2k39 s LEU 43 Ca 0.02 0.55 0.11 0.00 0.01 0.00 0.00 54.13 54.82 2k39 s LEU 43 Cb -0.13 -2.35 -0.05 0.00 0.01 0.00 0.00 46.19 43.67 2k39 s LEU 43 CO -0.07 0.17 -0.17 -0.63 1.01 0.00 0.00 176.35 176.66 2k39 s ILE 44 N 0.06 2.44 -0.27 -0.59 1.01 0.14 -0.60 121.20 123.39 2k39 s ILE 44 Ca 0.17 -2.35 -0.14 0.00 0.00 0.00 0.00 60.65 58.32 2k39 s ILE 44 Cb -0.13 -2.39 0.08 0.00 0.01 0.00 0.00 42.46 40.03 2k39 s ILE 44 CO 0.05 -0.35 0.65 0.12 0.00 0.00 0.00 174.94 175.40 2k39 s PHE 45 N -2.53 -1.04 -1.99 3.97 2.19 -0.64 -0.13 117.98 117.81 2k39 s PHE 45 Ca 0.31 2.05 0.00 0.00 0.33 0.00 0.00 56.93 59.62 2k39 s PHE 45 Cb -0.03 0.61 0.00 0.00 -1.31 0.00 0.00 43.02 42.29 2k39 s PHE 45 CO 0.15 -0.52 0.00 0.00 1.83 0.00 0.00 175.22 176.68 2k39 n ALA 46 N 4.47 -0.40 0.00 11.12 0.00 -1.26 -0.64 120.51 133.79 2k39 n ALA 46 Ca -0.19 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2k39 n ALA 46 Cb 0.57 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2k39 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k39 n GLY 47 N -0.68 0.53 3.20 0.00 0.00 -1.26 -5.07 105.19 101.91 2k39 n GLY 47 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 2k39 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k39 s LYS 48 N -0.94 2.93 0.57 1.61 1.02 0.18 -5.11 119.74 120.00 2k39 s LYS 48 Ca 0.00 -0.84 -0.18 0.00 0.02 0.00 0.00 55.97 54.97 2k39 s LYS 48 Cb 0.00 -2.23 -0.04 0.00 -0.52 0.00 0.00 37.83 35.04 2k39 s LYS 48 CO 0.00 0.15 1.11 -1.14 -0.92 0.00 0.00 175.35 174.55 2k39 s GLN 49 N 0.40 3.25 -0.35 1.68 0.74 -1.26 -1.61 119.66 122.51 2k39 s GLN 49 Ca -0.18 1.48 -0.13 0.00 0.05 0.00 0.00 55.36 56.59 2k39 s GLN 49 Cb -0.18 -2.00 -0.01 0.00 1.10 0.00 0.00 33.01 31.93 2k39 s GLN 49 CO 0.08 -0.91 0.24 -0.51 -0.55 0.00 0.00 175.29 173.64 2k39 s LEU 50 N -4.12 4.60 -0.12 3.68 2.01 0.23 -4.96 118.68 120.00 2k39 s LEU 50 Ca 0.70 -0.57 -0.06 0.00 0.01 0.00 0.00 54.13 54.20 2k39 s LEU 50 Cb -0.21 -2.12 -0.04 0.00 0.01 0.00 0.00 46.19 43.83 2k39 s LEU 50 CO 0.31 -0.28 0.12 -0.70 1.01 0.00 0.00 176.35 176.80 2k39 s GLU 51 N 1.69 3.41 -0.02 1.70 2.12 -1.26 -4.62 118.70 121.71 2k39 s GLU 51 Ca 0.05 -0.18 -0.18 0.00 0.36 0.00 0.00 54.97 55.03 2k39 s GLU 51 Cb -0.18 -3.14 -0.09 0.00 0.26 0.00 0.00 34.13 30.98 2k39 s GLU 51 CO 0.10 0.74 0.49 -3.47 -0.54 0.00 0.00 175.26 172.58 2k39 n ASP 52 N 2.09 0.04 0.00 -1.70 2.03 -1.26 -3.32 116.55 114.44 2k39 n ASP 52 Ca -0.20 0.51 0.00 0.00 0.52 0.00 0.00 54.79 55.63 2k39 n ASP 52 Cb 0.55 -0.40 0.00 0.00 -0.72 0.00 0.00 41.12 40.54 2k39 n ASP 52 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k39 n GLY 53 N 0.75 1.29 3.86 0.27 0.00 -1.26 -5.01 105.19 105.09 2k39 n GLY 53 Ca 0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 2k39 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k39 s ARG 54 N -0.67 3.10 0.10 1.61 0.52 -1.21 -4.97 118.95 117.42 2k39 s ARG 54 Ca 0.00 -0.81 0.06 0.00 -0.52 0.00 0.00 55.73 54.46 2k39 s ARG 54 Cb 0.00 -2.74 -0.04 0.00 0.52 0.00 0.00 34.95 32.69 2k39 s ARG 54 CO 0.00 0.48 -0.07 0.95 0.02 0.00 0.00 175.30 176.67 2k39 s THR 55 N -1.83 3.54 0.14 0.02 -4.23 -1.26 -3.43 115.64 108.59 2k39 s THR 55 Ca 0.32 -1.19 -0.17 0.00 -1.18 0.00 0.00 61.69 59.48 2k39 s THR 55 Cb -0.10 -2.66 -0.01 0.00 1.34 0.00 0.00 72.50 71.07 2k39 s THR 55 CO 0.25 0.12 1.77 -0.07 -0.54 0.00 0.00 174.62 176.15 2k39 h LEU 56 N 3.58 0.42 -0.28 4.79 3.38 -1.39 -1.90 115.31 123.91 2k39 h LEU 56 Ca -0.49 -0.05 -0.20 0.00 0.09 0.00 0.00 57.88 57.24 2k39 h LEU 56 Cb 1.17 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2k39 h LEU 56 CO 0.54 0.34 -0.87 -1.28 0.09 0.00 0.00 178.44 177.26 2k39 h SER 57 N 0.46 0.31 -0.11 -0.43 0.87 -1.57 -0.91 113.55 112.17 2k39 h SER 57 Ca 0.13 -0.24 -0.02 0.00 -1.23 0.00 0.00 61.79 60.43 2k39 h SER 57 Cb 0.00 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2k39 h SER 57 CO -0.02 1.04 0.03 -0.78 -0.53 0.00 0.00 176.83 176.56 2k39 h ASP 58 N 0.13 0.21 1.22 6.23 3.58 -1.79 -1.94 116.42 124.06 2k39 h ASP 58 Ca -0.05 -0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.36 2k39 h ASP 58 Cb 1.49 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 42.49 2k39 h ASP 58 CO 0.14 0.23 -0.13 1.88 -2.88 0.00 0.00 179.24 178.48 2k39 h TYR 59 N 0.24 0.00 -0.78 0.28 0.05 -1.06 -3.48 116.97 112.21 2k39 h TYR 59 Ca 0.06 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.84 2k39 h TYR 59 Cb 0.11 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.85 2k39 h TYR 59 CO 0.00 0.13 0.00 -1.71 -1.05 0.00 0.00 178.16 175.53 2k39 n ASN 60 N -3.22 -1.04 -4.79 3.88 5.15 -0.73 -5.08 115.26 109.43 2k39 n ASN 60 Ca 0.01 0.00 -0.36 0.00 -0.60 0.00 0.00 54.58 53.63 2k39 n ASN 60 Cb 0.44 -0.26 -0.06 0.00 -0.53 0.00 0.00 39.78 39.36 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2k39 s ILE 61 N -2.28 4.19 0.35 -1.44 -1.09 -0.40 -4.99 121.20 115.54 2k39 s ILE 61 Ca 0.00 1.68 0.04 0.00 -2.23 0.00 0.00 60.65 60.15 2k39 s ILE 61 Cb 0.00 -3.87 -0.02 0.00 -1.58 0.00 0.00 42.46 36.99 2k39 s ILE 61 CO 0.00 0.02 0.16 0.00 -1.23 0.00 0.00 174.94 173.89 2k39 n GLN 62 N 0.20 0.56 -2.26 2.79 10.64 -1.26 -4.52 117.38 123.53 2k39 n GLN 62 Ca 0.03 -3.04 -0.43 0.00 -1.83 0.00 0.00 57.00 51.74 2k39 n GLN 62 Cb 0.51 1.84 -0.02 0.00 -0.86 0.00 0.00 30.24 31.70 2k39 n GLN 62 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.06 175.44 2k39 s LYS 63 N -3.34 3.70 -0.36 2.61 2.20 -1.26 -2.08 119.74 121.21 2k39 s LYS 63 Ca 0.22 1.29 -0.00 0.00 -0.36 0.00 0.00 55.97 57.12 2k39 s LYS 63 Cb 0.01 -4.01 0.00 0.00 -1.51 0.00 0.00 37.83 32.32 2k39 s LYS 63 CO 0.16 -1.40 0.04 0.39 -0.36 0.00 0.00 175.35 174.18 2k39 n GLU 64 N 7.79 -0.59 -2.29 4.03 1.02 -0.95 -5.04 120.64 124.61 2k39 n GLU 64 Ca 0.17 0.20 -0.40 0.00 -0.02 0.00 0.00 57.16 57.12 2k39 n GLU 64 Cb 0.47 -3.82 -0.03 0.00 -0.02 0.00 0.00 31.44 28.04 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2k39 s SER 65 N -2.85 6.92 -0.19 1.62 0.01 -0.89 -4.75 113.70 113.58 2k39 s SER 65 Ca 0.02 2.46 -0.08 0.00 1.31 0.00 0.00 55.95 59.66 2k39 s SER 65 Cb -0.01 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.54 2k39 s SER 65 CO 0.03 -0.40 0.09 -0.89 0.41 0.00 0.00 173.24 172.47 2k39 s THR 66 N -1.20 5.01 0.18 1.44 2.01 -1.26 -0.84 115.64 120.99 2k39 s THR 66 Ca 0.49 0.05 0.10 0.00 0.31 0.00 0.00 61.69 62.63 2k39 s THR 66 Cb -0.35 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 2k39 s THR 66 CO 0.46 0.45 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.92 2k39 s LEU 67 N 0.37 2.75 -0.25 4.42 1.02 0.11 -4.93 118.68 122.17 2k39 s LEU 67 Ca 0.05 -0.69 -0.06 0.00 0.02 0.00 0.00 54.13 53.45 2k39 s LEU 67 Cb -0.12 -1.46 -0.01 0.00 0.02 0.00 0.00 46.19 44.63 2k39 s LEU 67 CO -0.01 0.11 0.03 -2.28 0.02 0.00 0.00 176.35 174.23 2k39 s HIS 68 N -1.68 3.06 -0.17 0.29 5.65 0.82 -0.48 115.29 122.79 2k39 s HIS 68 Ca 0.23 -0.80 -0.16 0.00 0.25 0.00 0.00 55.06 54.58 2k39 s HIS 68 Cb -0.08 -2.19 -0.04 0.00 -1.18 0.00 0.00 32.58 29.08 2k39 s HIS 68 CO 0.13 -0.50 0.41 -1.17 -0.65 0.00 0.00 174.74 172.95 2k39 s LEU 69 N 1.53 4.21 -0.08 8.88 0.20 -0.77 0.26 118.68 132.90 2k39 s LEU 69 Ca 0.05 0.61 0.00 0.00 0.69 0.00 0.00 54.13 55.49 2k39 s LEU 69 Cb -0.15 -2.55 -0.03 0.00 -0.43 0.00 0.00 46.19 43.03 2k39 s LEU 69 CO 0.01 -0.02 -0.07 0.68 -0.29 0.00 0.00 176.35 176.66 2k39 s VAL 70 N 0.93 3.72 -0.25 1.68 -7.23 0.12 -2.50 120.40 116.87 2k39 s VAL 70 Ca 0.21 -0.47 -0.10 0.00 -1.81 0.00 0.00 61.98 59.82 2k39 s VAL 70 Cb -0.14 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 2k39 s VAL 70 CO 0.08 0.59 0.14 -0.22 -0.31 0.00 0.00 175.10 175.37 2k39 s LEU 71 N -0.65 3.90 0.00 1.32 0.20 -1.26 0.40 118.68 122.59 2k39 s LEU 71 Ca 0.10 -0.01 0.00 0.00 0.69 0.00 0.00 54.13 54.91 2k39 s LEU 71 Cb -0.11 -2.06 0.00 0.00 -0.43 0.00 0.00 46.19 43.59 2k39 s LEU 71 CO 0.02 0.01 0.00 -1.14 -0.29 0.00 0.00 176.35 174.95 2k39 n ARG 72 N 4.63 0.00 -1.59 1.98 0.63 0.12 -4.96 116.66 117.47 2k39 n ARG 72 Ca -0.15 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.41 2k39 n ARG 72 Cb 0.52 -0.18 0.07 0.00 0.45 0.00 0.00 32.46 33.32 2k39 n ARG 72 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2k39 n LEU 73 N 0.00 4.76 -4.76 6.15 4.77 -1.26 -4.95 117.00 121.70 2k39 n LEU 73 Ca 0.00 0.78 -0.40 0.00 -0.03 0.00 0.00 56.01 56.36 2k39 n LEU 73 Cb 0.00 -1.47 -0.03 0.00 -2.33 0.00 0.00 43.42 39.58 2k39 n LEU 73 CO 0.00 -1.51 0.84 -0.60 -1.33 0.00 0.00 177.39 174.79 2k39 s ARG 74 N -3.21 4.49 0.00 3.23 3.52 -1.26 -4.94 118.95 120.78 2k39 s ARG 74 Ca 0.79 1.90 0.00 0.00 -0.13 0.00 0.00 55.73 58.28 2k39 s ARG 74 Cb -0.38 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 29.93 2k39 s ARG 74 CO 0.44 0.05 0.35 0.41 -0.81 0.00 0.00 175.30 175.74 2k39 n GLY 75 N 1.00 -0.33 0.00 8.12 0.00 -1.26 -5.12 105.19 107.60 2k39 n GLY 75 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93