#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 3.95 0.29 3.17 -0.21 -1.26 -1.51 119.66 124.09 2k39 s GLN 2 Ca 0.00 1.03 0.04 0.00 0.02 0.00 0.00 55.36 56.45 2k39 s GLN 2 Cb 0.00 -2.14 -0.02 0.00 1.00 0.00 0.00 33.01 31.86 2k39 s GLN 2 CO 0.00 -0.27 0.15 0.44 -2.12 0.00 0.00 175.29 173.49 2k39 n ILE 3 N -1.37 0.00 -3.84 1.08 -5.35 -0.32 -0.94 119.36 108.61 2k39 n ILE 3 Ca 0.07 -1.85 -0.12 0.00 -0.27 0.00 0.00 62.75 60.58 2k39 n ILE 3 Cb 0.54 0.76 -0.13 0.00 -1.74 0.00 0.00 39.64 39.07 2k39 n ILE 3 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2k39 s PHE 4 N -2.85 -0.08 -0.26 4.28 0.08 -0.51 -3.12 117.98 115.52 2k39 s PHE 4 Ca 0.22 0.20 0.03 0.00 0.12 0.00 0.00 56.93 57.50 2k39 s PHE 4 Cb 0.01 0.02 0.06 0.00 -0.57 0.00 0.00 43.02 42.54 2k39 s PHE 4 CO 0.15 -0.04 -0.10 0.08 -0.10 0.00 0.00 175.22 175.21 2k39 s VAL 5 N 0.10 2.14 -0.21 -0.44 1.01 -0.66 -0.90 120.40 121.44 2k39 s VAL 5 Ca -0.01 -1.67 -0.22 0.00 0.00 0.00 0.00 61.98 60.08 2k39 s VAL 5 Cb -0.01 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 2k39 s VAL 5 CO -0.00 -0.07 0.71 -0.75 0.00 0.00 0.00 175.10 174.98 2k39 s LYS 6 N 1.10 4.21 0.84 2.72 2.20 0.62 -1.94 119.74 129.49 2k39 s LYS 6 Ca -0.07 0.75 -0.10 0.00 -0.36 0.00 0.00 55.97 56.18 2k39 s LYS 6 Cb -0.20 -3.60 0.10 0.00 -1.51 0.00 0.00 37.83 32.62 2k39 s LYS 6 CO -0.05 -0.34 1.11 0.95 -0.36 0.00 0.00 175.35 176.66 2k39 s THR 7 N 2.23 2.75 0.35 3.43 -4.23 0.11 -1.71 115.64 118.57 2k39 s THR 7 Ca 0.31 0.24 0.16 0.00 -1.18 0.00 0.00 61.69 61.23 2k39 s THR 7 Cb -0.16 -2.53 0.34 0.00 1.34 0.00 0.00 72.50 71.50 2k39 s THR 7 CO 0.10 -0.32 1.67 0.25 -0.54 0.00 0.00 174.62 175.78 2k39 h LEU 8 N -1.48 0.50 -0.03 4.79 6.46 -1.71 -2.21 115.31 121.63 2k39 h LEU 8 Ca -0.44 0.18 0.00 0.00 -0.12 0.00 0.00 57.88 57.50 2k39 h LEU 8 Cb 1.25 0.13 0.00 0.00 -0.73 0.00 0.00 40.66 41.31 2k39 h LEU 8 CO 0.47 -0.12 -0.53 0.35 -0.62 0.00 0.00 178.44 177.99 2k39 n THR 9 N -5.00 0.00 0.00 1.05 -2.24 -1.26 -4.94 114.28 101.88 2k39 n THR 9 Ca 0.32 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 2k39 n THR 9 Cb 1.01 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.56 2k39 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k39 n GLY 10 N 1.49 1.24 3.72 3.38 0.00 -0.83 -5.09 105.19 109.09 2k39 n GLY 10 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.26 4.51 0.05 1.61 2.20 -1.26 -4.83 119.74 121.75 2k39 s LYS 11 Ca 0.00 1.63 0.06 0.00 -0.36 0.00 0.00 55.97 57.30 2k39 s LYS 11 Cb 0.00 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.91 2k39 s LYS 11 CO 0.00 -0.13 -0.10 0.99 -0.36 0.00 0.00 175.35 175.75 2k39 s THR 12 N 0.84 3.35 -0.01 3.43 2.01 -1.26 0.07 115.64 124.06 2k39 s THR 12 Ca 0.55 -1.07 -0.06 0.00 0.31 0.00 0.00 61.69 61.43 2k39 s THR 12 Cb -0.26 -2.49 0.00 0.00 0.01 0.00 0.00 72.50 69.76 2k39 s THR 12 CO 0.30 0.27 0.12 0.27 -0.69 0.00 0.00 174.62 174.88 2k39 s ILE 13 N -1.07 0.06 -0.05 1.82 -4.36 -0.82 -5.00 121.20 111.78 2k39 s ILE 13 Ca 0.18 -0.48 -0.21 0.00 -0.26 0.00 0.00 60.65 59.88 2k39 s ILE 13 Cb -0.11 -0.34 -0.05 0.00 1.25 0.00 0.00 42.46 43.22 2k39 s ILE 13 CO 0.10 -0.27 0.59 -0.89 0.24 0.00 0.00 174.94 174.71 2k39 s THR 14 N -0.90 5.02 0.15 8.37 2.01 -1.26 -1.66 115.64 127.35 2k39 s THR 14 Ca -0.10 1.21 0.06 0.00 0.31 0.00 0.00 61.69 63.17 2k39 s THR 14 Cb -0.06 -3.92 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 2k39 s THR 14 CO 0.01 0.36 0.03 -0.76 -0.69 0.00 0.00 174.62 173.57 2k39 s LEU 15 N 0.24 3.49 -0.37 4.42 1.43 -1.18 -5.00 118.68 121.71 2k39 s LEU 15 Ca 0.31 -0.26 -0.12 0.00 -1.03 0.00 0.00 54.13 53.04 2k39 s LEU 15 Cb -0.17 -2.15 0.02 0.00 0.03 0.00 0.00 46.19 43.91 2k39 s LEU 15 CO 0.16 0.11 0.22 -0.70 0.23 0.00 0.00 176.35 176.36 2k39 s GLU 16 N -2.79 3.00 -0.02 1.70 2.12 -1.26 -1.17 118.70 120.27 2k39 s GLU 16 Ca 0.28 -0.97 0.06 0.00 0.36 0.00 0.00 54.97 54.70 2k39 s GLU 16 Cb -0.10 -3.76 -0.01 0.00 0.26 0.00 0.00 34.13 30.52 2k39 s GLU 16 CO 0.20 -0.64 -0.22 0.14 -0.54 0.00 0.00 175.26 174.20 2k39 s VAL 17 N 1.60 1.72 0.40 3.70 -7.23 -0.57 -4.96 120.40 115.05 2k39 s VAL 17 Ca 0.03 -0.92 -0.23 0.00 -1.81 0.00 0.00 61.98 59.05 2k39 s VAL 17 Cb -0.19 -1.44 -0.10 0.00 0.56 0.00 0.00 36.38 35.22 2k39 s VAL 17 CO 0.08 0.49 0.99 -1.61 -0.31 0.00 0.00 175.10 174.73 2k39 s GLU 18 N -0.40 4.26 0.62 4.82 0.41 -1.26 -1.43 118.70 125.72 2k39 s GLU 18 Ca 0.05 1.34 0.37 0.00 -0.41 0.00 0.00 54.97 56.33 2k39 s GLU 18 Cb -0.09 -2.47 2.07 0.00 -1.78 0.00 0.00 34.13 31.85 2k39 s GLU 18 CO 0.00 -0.03 2.28 -1.35 -0.49 0.00 0.00 175.26 175.68 2k39 h PRO 19 N 2.43 0.00 0.00 0.39 0.11 -1.98 -1.79 132.00 131.16 2k39 h PRO 19 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2k39 h PRO 19 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2k39 h PRO 19 CO 0.62 0.01 -0.07 -1.13 -0.21 0.00 0.00 178.00 177.22 2k39 n SER 20 N -3.41 0.45 -4.66 -2.05 3.41 -1.26 -2.02 113.62 104.08 2k39 n SER 20 Ca -0.03 0.46 -0.43 0.00 -0.26 0.00 0.00 58.87 58.62 2k39 n SER 20 Cb 0.10 -0.54 -0.02 0.00 -0.26 0.00 0.00 64.21 63.49 2k39 n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2k39 s ASP 21 N -3.78 6.85 1.03 4.04 1.01 -0.68 -4.65 116.67 120.49 2k39 s ASP 21 Ca 0.12 1.80 -0.12 0.00 0.71 0.00 0.00 52.55 55.06 2k39 s ASP 21 Cb 0.15 -2.54 0.21 0.00 1.01 0.00 0.00 42.92 41.75 2k39 s ASP 21 CO 0.58 -0.83 1.07 0.42 0.21 0.00 0.00 175.17 176.63 2k39 s THR 22 N 3.72 2.19 0.34 -1.27 -4.23 -1.26 -3.72 115.64 111.40 2k39 s THR 22 Ca 0.60 0.06 0.07 0.00 -1.18 0.00 0.00 61.69 61.24 2k39 s THR 22 Cb -0.24 -2.37 0.31 0.00 1.34 0.00 0.00 72.50 71.54 2k39 s THR 22 CO 0.19 -0.08 1.86 0.40 -0.54 0.00 0.00 174.62 176.45 2k39 h ILE 23 N -2.07 0.85 0.00 2.99 1.08 -1.64 -2.54 117.51 116.18 2k39 h ILE 23 Ca -0.55 -0.26 -0.10 0.00 -0.39 0.00 0.00 64.86 63.56 2k39 h ILE 23 Cb 1.32 0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 35.09 2k39 h ILE 23 CO 0.53 0.14 -0.48 -0.33 -0.69 0.00 0.00 178.15 177.32 2k39 h GLU 24 N 0.75 0.00 0.00 2.37 3.07 -1.91 -2.76 114.58 116.11 2k39 h GLU 24 Ca 0.46 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.30 2k39 h GLU 24 Cb 0.67 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.58 2k39 h GLU 24 CO -0.22 0.48 -0.06 -0.97 -1.40 0.00 0.00 179.01 176.84 2k39 h ASN 25 N 0.00 0.00 0.10 1.42 -0.73 -1.79 -2.04 115.58 112.54 2k39 h ASN 25 Ca -0.00 0.00 -0.21 0.00 1.87 0.00 0.00 56.30 57.96 2k39 h ASN 25 Cb 0.92 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.51 2k39 h ASN 25 CO 0.06 0.06 -1.01 0.58 -0.37 0.00 0.00 177.43 176.76 2k39 h VAL 26 N 0.00 1.29 0.00 2.57 2.07 -1.58 -3.34 116.25 117.27 2k39 h VAL 26 Ca -0.00 -2.43 -0.06 0.00 0.82 0.00 0.00 66.70 65.03 2k39 h VAL 26 Cb 0.32 2.94 -0.01 0.00 -1.52 0.00 0.00 31.29 33.02 2k39 h VAL 26 CO 0.01 0.66 -0.28 0.07 0.02 0.00 0.00 177.57 178.05 2k39 h LYS 27 N -0.47 0.00 -0.19 1.57 2.10 -1.52 -2.61 116.57 115.44 2k39 h LYS 27 Ca -0.21 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.33 2k39 h LYS 27 Cb 1.59 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.90 2k39 h LYS 27 CO 0.06 0.28 -0.36 0.00 -2.00 0.00 0.00 179.45 177.43 2k39 h ALA 28 N 1.72 1.02 0.13 0.07 0.00 -1.54 -2.64 119.26 118.02 2k39 h ALA 28 Ca -0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2k39 h ALA 28 Cb 0.98 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2k39 h ALA 28 CO 0.04 0.60 -0.06 0.87 0.00 0.00 0.00 179.25 180.69 2k39 h LYS 29 N 0.35 -0.16 -0.94 0.00 1.57 -1.59 -3.38 116.57 112.41 2k39 h LYS 29 Ca 0.04 0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.97 2k39 h LYS 29 Cb 0.80 0.04 -0.15 0.00 0.08 0.00 0.00 32.23 33.00 2k39 h LYS 29 CO 0.06 0.31 -0.39 -0.89 -0.57 0.00 0.00 179.45 177.98 2k39 n ILE 30 N -4.88 -0.51 0.30 1.86 5.41 -1.03 -2.14 119.36 118.37 2k39 n ILE 30 Ca -0.08 2.21 0.19 0.00 1.00 0.00 0.00 62.75 66.08 2k39 n ILE 30 Cb 0.27 -2.90 0.92 0.00 -0.71 0.00 0.00 39.64 37.22 2k39 n ILE 30 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 176.55 176.61 2k39 h GLN 31 N 0.00 0.00 0.00 0.38 3.07 -1.41 0.09 115.11 117.23 2k39 h GLN 31 Ca 0.31 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.91 2k39 h GLN 31 Cb 0.54 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.08 2k39 h GLN 31 CO -0.93 0.02 -1.37 -3.47 0.09 0.00 0.00 178.83 173.17 2k39 n ASP 32 N -3.17 0.84 -0.13 0.06 2.03 -0.91 -3.33 116.55 111.94 2k39 n ASP 32 Ca -0.01 0.36 -0.27 0.00 0.52 0.00 0.00 54.79 55.39 2k39 n ASP 32 Cb 0.20 0.23 -0.10 0.00 -0.72 0.00 0.00 41.12 40.73 2k39 n ASP 32 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2k39 n LYS 33 N -2.85 0.58 -0.06 -0.67 4.01 -0.84 -4.64 118.16 113.69 2k39 n LYS 33 Ca -0.08 0.34 0.01 0.00 -0.51 0.00 0.00 58.31 58.07 2k39 n LYS 33 Cb 0.80 -1.55 0.02 0.00 -0.51 0.00 0.00 35.03 33.78 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 -4.31 1.42 -0.55 1.97 -0.58 -0.04 -5.04 120.64 113.50 2k39 n GLU 34 Ca -0.47 -1.22 0.00 0.00 -0.42 0.00 0.00 57.16 55.05 2k39 n GLU 34 Cb 0.81 -0.83 0.00 0.00 -0.57 0.00 0.00 31.44 30.85 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 -0.38 1.40 3.59 0.62 0.00 -0.94 -4.96 105.19 104.51 2k39 n GLY 35 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.37 3.69 0.69 -0.61 1.01 -1.26 -4.83 121.20 116.53 2k39 s ILE 36 Ca 0.00 0.65 -0.11 0.00 0.00 0.00 0.00 60.65 61.19 2k39 s ILE 36 Cb 0.00 -4.07 0.01 0.00 0.01 0.00 0.00 42.46 38.41 2k39 s ILE 36 CO 0.00 -0.77 1.06 -2.16 0.00 0.00 0.00 174.94 173.07 2k39 s PRO 37 N 5.53 2.96 0.41 2.79 0.04 -1.26 -3.10 135.00 142.38 2k39 s PRO 37 Ca 0.65 0.88 0.19 0.00 0.04 0.00 0.00 61.00 62.75 2k39 s PRO 37 Cb -0.15 -2.00 1.11 0.00 0.04 0.00 0.00 34.50 33.49 2k39 s PRO 37 CO 0.30 -1.06 1.82 -1.00 0.04 0.00 0.00 177.00 177.10 2k39 h PRO 38 N -0.69 0.38 0.00 0.56 0.13 -1.94 -2.78 132.00 127.66 2k39 h PRO 38 Ca -0.44 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2k39 h PRO 38 Cb 1.21 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2k39 h PRO 38 CO 0.58 0.25 0.00 -0.44 -0.23 0.00 0.00 178.00 178.16 2k39 h ASP 39 N 0.39 0.00 0.00 1.44 3.32 -2.00 -3.10 116.42 116.47 2k39 h ASP 39 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 2k39 h ASP 39 Cb 1.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.89 2k39 h ASP 39 CO -0.22 0.00 -0.04 0.00 -1.72 0.00 0.00 179.24 177.27 2k39 n GLN 40 N -2.92 1.88 -3.78 3.56 6.02 -1.05 -5.04 117.38 116.03 2k39 n GLN 40 Ca -0.02 -1.76 -0.36 0.00 -0.01 0.00 0.00 57.00 54.86 2k39 n GLN 40 Cb 0.12 -1.10 -0.10 0.00 1.02 0.00 0.00 30.24 30.19 2k39 n GLN 40 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2k39 s GLN 41 N -1.51 4.00 -0.23 -1.09 2.00 -1.18 -2.29 119.66 119.37 2k39 s GLN 41 Ca 0.11 -0.31 -0.02 0.00 -2.00 0.00 0.00 55.36 53.15 2k39 s GLN 41 Cb 0.10 -3.41 0.07 0.00 0.80 0.00 0.00 33.01 30.57 2k39 s GLN 41 CO 0.01 0.11 0.03 0.50 -0.50 0.00 0.00 175.29 175.44 2k39 s ARG 42 N 0.86 0.91 -0.18 1.67 3.52 -1.10 -4.98 118.95 119.65 2k39 s ARG 42 Ca 0.06 -0.70 -0.17 0.00 -0.13 0.00 0.00 55.73 54.79 2k39 s ARG 42 Cb -0.13 -2.22 -0.04 0.00 -1.56 0.00 0.00 34.95 31.00 2k39 s ARG 42 CO 0.03 -0.70 0.44 -0.51 -0.81 0.00 0.00 175.30 173.75 2k39 s LEU 43 N 1.69 4.19 0.03 -0.88 1.43 -1.26 -0.33 118.68 123.55 2k39 s LEU 43 Ca -0.00 0.63 0.05 0.00 -1.03 0.00 0.00 54.13 53.78 2k39 s LEU 43 Cb -0.18 -2.60 -0.02 0.00 0.03 0.00 0.00 46.19 43.43 2k39 s LEU 43 CO -0.11 -0.07 -0.15 0.27 0.23 0.00 0.00 176.35 176.52 2k39 s ILE 44 N 1.14 1.21 -0.02 -0.59 -4.36 -0.47 -0.17 121.20 117.94 2k39 s ILE 44 Ca 0.22 -0.94 0.01 0.00 -0.26 0.00 0.00 60.65 59.68 2k39 s ILE 44 Cb -0.15 -1.07 0.01 0.00 1.25 0.00 0.00 42.46 42.51 2k39 s ILE 44 CO 0.09 0.11 -0.02 0.12 0.24 0.00 0.00 174.94 175.48 2k39 s PHE 45 N -0.72 0.38 -1.53 1.37 5.36 -0.49 -3.01 117.98 119.33 2k39 s PHE 45 Ca 0.03 -0.05 0.00 0.00 -0.96 0.00 0.00 56.93 55.95 2k39 s PHE 45 Cb -0.07 -0.37 0.00 0.00 -0.34 0.00 0.00 43.02 42.24 2k39 s PHE 45 CO 0.01 -0.09 0.00 0.00 -1.46 0.00 0.00 175.22 173.68 2k39 n ALA 46 N 3.68 -0.23 0.00 11.12 0.00 -1.26 -0.88 120.51 132.94 2k39 n ALA 46 Ca -0.21 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2k39 n ALA 46 Cb 0.54 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 18.39 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 -1.18 3.28 3.80 0.00 0.00 -1.26 -5.05 105.19 104.78 2k39 n GLY 47 Ca -0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.60 4.44 -0.25 1.61 1.02 -0.06 -5.06 119.74 120.85 2k39 s LYS 48 Ca 0.00 1.21 -0.11 0.00 0.02 0.00 0.00 55.97 57.10 2k39 s LYS 48 Cb 0.00 -2.62 -0.05 0.00 -0.52 0.00 0.00 37.83 34.64 2k39 s LYS 48 CO 0.00 0.20 0.17 -0.65 -0.92 0.00 0.00 175.35 174.14 2k39 s GLN 49 N -2.40 4.05 -0.22 1.68 -0.21 -1.26 -1.40 119.66 119.90 2k39 s GLN 49 Ca 0.53 -0.28 -0.29 0.00 0.02 0.00 0.00 55.36 55.34 2k39 s GLN 49 Cb -0.15 -3.56 -0.02 0.00 1.00 0.00 0.00 33.01 30.27 2k39 s GLN 49 CO 0.20 0.01 1.51 -0.51 -2.12 0.00 0.00 175.29 174.39 2k39 s LEU 50 N 1.20 3.95 0.04 2.90 1.43 0.76 -4.98 118.68 123.99 2k39 s LEU 50 Ca 0.07 1.58 -0.27 0.00 -1.03 0.00 0.00 54.13 54.48 2k39 s LEU 50 Cb -0.14 -3.53 -0.05 0.00 0.03 0.00 0.00 46.19 42.50 2k39 s LEU 50 CO 0.06 -1.14 0.85 -1.61 0.23 0.00 0.00 176.35 174.73 2k39 s GLU 51 N 4.40 4.56 0.31 1.70 2.02 -1.26 -4.74 118.70 125.69 2k39 s GLU 51 Ca 0.66 1.21 -0.25 0.00 0.02 0.00 0.00 54.97 56.62 2k39 s GLU 51 Cb -0.23 -3.39 -0.16 0.00 0.10 0.00 0.00 34.13 30.45 2k39 s GLU 51 CO 0.26 0.18 0.42 -0.25 0.02 0.00 0.00 175.26 175.89 2k39 n ASP 52 N 3.09 -1.54 0.00 -0.19 9.92 -1.26 -3.77 116.55 122.80 2k39 n ASP 52 Ca 0.00 0.99 0.00 0.00 -0.53 0.00 0.00 54.79 55.25 2k39 n ASP 52 Cb 0.50 -0.98 0.00 0.00 -0.64 0.00 0.00 41.12 40.00 2k39 n ASP 52 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2k39 n GLY 53 N 2.02 2.77 3.76 0.44 0.00 -1.26 -4.96 105.19 107.95 2k39 n GLY 53 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.41 4.60 0.31 1.61 1.81 -1.25 -4.81 118.95 120.82 2k39 s ARG 54 Ca 0.00 1.78 -0.29 0.00 -1.72 0.00 0.00 55.73 55.51 2k39 s ARG 54 Cb 0.00 -3.14 -0.10 0.00 -0.45 0.00 0.00 34.95 31.26 2k39 s ARG 54 CO 0.00 0.18 1.27 0.95 -0.68 0.00 0.00 175.30 177.03 2k39 s THR 55 N -1.20 2.89 0.53 0.02 -4.23 -1.26 -1.71 115.64 110.69 2k39 s THR 55 Ca 0.45 0.88 0.28 0.00 -1.18 0.00 0.00 61.69 62.12 2k39 s THR 55 Cb -0.31 -3.56 0.43 0.00 1.34 0.00 0.00 72.50 70.40 2k39 s THR 55 CO 0.40 0.20 1.95 -0.07 -0.54 0.00 0.00 174.62 176.56 2k39 h LEU 56 N 3.64 0.01 -0.27 4.79 3.38 -1.55 -2.72 115.31 122.59 2k39 h LEU 56 Ca -0.48 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.28 2k39 h LEU 56 Cb 1.22 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2k39 h LEU 56 CO 0.67 0.00 -0.84 -1.28 0.09 0.00 0.00 178.44 177.08 2k39 h SER 57 N 0.01 0.55 0.03 -0.43 0.87 -1.68 -2.46 113.55 110.43 2k39 h SER 57 Ca 0.33 -0.40 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 2k39 h SER 57 Cb 1.31 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2k39 h SER 57 CO -0.01 1.17 0.00 -0.78 -0.53 0.00 0.00 176.83 176.69 2k39 h ASP 58 N 0.28 0.00 -0.67 6.23 3.58 -1.78 -1.42 116.42 122.63 2k39 h ASP 58 Ca -0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.39 2k39 h ASP 58 Cb 1.45 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.50 2k39 h ASP 58 CO 0.15 0.00 0.00 -1.22 -2.88 0.00 0.00 179.24 175.29 2k39 n TYR 59 N -2.73 1.23 -1.31 0.28 4.01 -0.93 -4.99 117.16 112.73 2k39 n TYR 59 Ca -0.02 -0.53 -0.07 0.00 -0.16 0.00 0.00 57.90 57.12 2k39 n TYR 59 Cb 0.06 -0.13 -0.03 0.00 -0.31 0.00 0.00 39.34 38.93 2k39 n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2k39 n ASN 60 N 1.32 -3.66 -4.73 7.72 4.13 -0.54 -4.97 115.26 114.54 2k39 n ASN 60 Ca 0.25 0.14 -0.41 0.00 1.68 0.00 0.00 54.58 56.24 2k39 n ASN 60 Cb 0.75 -1.90 -0.04 0.00 -1.54 0.00 0.00 39.78 37.05 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2k39 s ILE 61 N -2.26 4.26 0.42 2.41 -1.09 -1.19 -5.03 121.20 118.72 2k39 s ILE 61 Ca 0.00 1.90 0.07 0.00 -2.23 0.00 0.00 60.65 60.39 2k39 s ILE 61 Cb 0.00 -4.21 -0.04 0.00 -1.58 0.00 0.00 42.46 36.62 2k39 s ILE 61 CO 0.00 0.30 0.21 -1.10 -1.23 0.00 0.00 174.94 173.13 2k39 s GLN 62 N -0.12 2.27 0.31 2.79 -0.21 -1.26 -4.70 119.66 118.74 2k39 s GLN 62 Ca 0.48 -1.82 -0.28 0.00 0.02 0.00 0.00 55.36 53.76 2k39 s GLN 62 Cb -0.26 -2.03 -0.13 0.00 1.00 0.00 0.00 33.01 31.59 2k39 s GLN 62 CO 0.32 -0.15 1.06 0.36 -2.12 0.00 0.00 175.29 174.75 2k39 n LYS 63 N -1.30 1.50 -0.76 2.91 -0.00 -1.26 -3.57 118.16 115.67 2k39 n LYS 63 Ca -0.01 0.53 0.00 0.00 -0.00 0.00 0.00 58.31 58.83 2k39 n LYS 63 Cb 0.64 -1.95 0.00 0.00 -0.00 0.00 0.00 35.03 33.72 2k39 n LYS 63 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 2k39 n GLU 64 N 0.63 -0.14 -1.64 -1.58 0.28 -0.12 -4.98 120.64 113.09 2k39 n GLU 64 Ca 0.09 0.04 -0.40 0.00 -0.16 0.00 0.00 57.16 56.73 2k39 n GLU 64 Cb 0.33 -3.68 0.03 0.00 1.43 0.00 0.00 31.44 29.56 2k39 n GLU 64 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2k39 n SER 65 N -0.07 1.42 -4.36 -1.84 2.88 -1.23 -4.67 113.62 105.74 2k39 n SER 65 Ca 0.00 0.95 -0.43 0.00 -1.33 0.00 0.00 58.87 58.06 2k39 n SER 65 Cb 0.04 -1.41 -0.09 0.00 -0.75 0.00 0.00 64.21 62.00 2k39 n SER 65 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2k39 s THR 66 N -1.36 4.90 0.29 2.46 2.01 -1.26 -1.42 115.64 121.26 2k39 s THR 66 Ca 0.68 -1.13 0.05 0.00 0.31 0.00 0.00 61.69 61.61 2k39 s THR 66 Cb -0.48 -3.92 -0.02 0.00 0.01 0.00 0.00 72.50 68.09 2k39 s THR 66 CO 0.53 -0.52 0.42 -0.76 -0.69 0.00 0.00 174.62 173.59 2k39 s LEU 67 N 1.57 4.16 -0.11 4.42 1.02 -0.08 -4.95 118.68 124.71 2k39 s LEU 67 Ca 0.04 -0.02 0.00 0.00 0.02 0.00 0.00 54.13 54.17 2k39 s LEU 67 Cb -0.23 -2.84 -0.02 0.00 0.02 0.00 0.00 46.19 43.12 2k39 s LEU 67 CO 0.05 -0.23 -0.12 -1.00 0.02 0.00 0.00 176.35 175.07 2k39 s HIS 68 N -2.08 2.82 -0.36 0.29 3.76 -1.16 -0.28 115.29 118.28 2k39 s HIS 68 Ca 0.39 -0.45 -0.10 0.00 -0.15 0.00 0.00 55.06 54.75 2k39 s HIS 68 Cb -0.09 -1.80 0.03 0.00 1.11 0.00 0.00 32.58 31.82 2k39 s HIS 68 CO 0.30 -0.06 0.18 -1.17 -0.85 0.00 0.00 174.74 173.13 2k39 s LEU 69 N 0.03 4.53 -0.21 0.89 2.96 -0.70 -1.36 118.68 124.83 2k39 s LEU 69 Ca -0.04 -0.96 -0.29 0.00 -0.22 0.00 0.00 54.13 52.62 2k39 s LEU 69 Cb -0.14 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.56 2k39 s LEU 69 CO 0.04 -0.34 1.23 -0.69 -1.32 0.00 0.00 176.35 175.26 2k39 s VAL 70 N 1.53 4.33 -0.61 1.68 1.01 0.55 -2.00 120.40 126.89 2k39 s VAL 70 Ca 0.02 1.58 -0.26 0.00 0.00 0.00 0.00 61.98 63.32 2k39 s VAL 70 Cb -0.19 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 2k39 s VAL 70 CO 0.06 -0.23 2.02 -0.76 0.00 0.00 0.00 175.10 176.19 2k39 s LEU 71 N 3.64 3.30 0.30 3.92 1.43 -1.26 -2.73 118.68 127.28 2k39 s LEU 71 Ca 0.53 0.45 0.26 0.00 -1.03 0.00 0.00 54.13 54.33 2k39 s LEU 71 Cb -0.19 -2.52 0.88 0.00 0.03 0.00 0.00 46.19 44.39 2k39 s LEU 71 CO 0.15 -2.57 1.76 -0.09 0.23 0.00 0.00 176.35 175.83 2k39 h ARG 72 N 15.84 0.00 -4.79 1.70 9.65 -1.84 -3.42 114.38 131.53 2k39 h ARG 72 Ca -0.22 0.00 -0.37 0.00 -1.10 0.00 0.00 59.98 58.29 2k39 h ARG 72 Cb 1.17 0.00 -0.14 0.00 -1.39 0.00 0.00 29.97 29.61 2k39 h ARG 72 CO 1.20 0.00 -0.56 -0.48 2.80 0.00 0.00 179.97 182.93 2k39 s LEU 73 N -4.96 1.51 0.02 3.80 -0.00 -1.26 -5.07 118.68 112.73 2k39 s LEU 73 Ca 0.07 -1.55 0.00 0.00 -0.00 0.00 0.00 54.13 52.64 2k39 s LEU 73 Cb 0.10 0.36 0.00 0.00 -0.00 0.00 0.00 46.19 46.64 2k39 s LEU 73 CO 0.53 -0.92 0.00 -1.14 -0.00 0.00 0.00 176.35 174.82 2k39 n ARG 74 N -0.48 0.00 0.00 1.48 0.63 -1.26 -5.17 116.66 111.86 2k39 n ARG 74 Ca 0.03 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.96 2k39 n ARG 74 Cb 0.65 -0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.56 2k39 n ARG 74 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k39 n GLY 75 N 1.53 3.22 0.00 5.14 0.00 -1.26 -5.28 105.19 108.54 2k39 n GLY 75 Ca 0.00 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.31 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93