#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 4.47 0.19 2.12 -0.44 -1.26 -0.72 119.66 124.02 2k39 s GLN 2 Ca 0.00 1.84 0.10 0.00 -2.50 0.00 0.00 55.36 54.81 2k39 s GLN 2 Cb 0.00 -3.28 -0.04 0.00 -1.64 0.00 0.00 33.01 28.05 2k39 s GLN 2 CO 0.00 -0.16 -0.21 0.96 0.50 0.00 0.00 175.29 176.38 2k39 s ILE 3 N 0.38 2.12 -0.20 -2.34 -4.36 0.66 -1.31 121.20 116.15 2k39 s ILE 3 Ca 0.55 -2.02 -0.08 0.00 -0.26 0.00 0.00 60.65 58.84 2k39 s ILE 3 Cb -0.32 -2.02 -0.04 0.00 1.25 0.00 0.00 42.46 41.33 2k39 s ILE 3 CO 0.34 -0.24 0.09 -0.36 0.24 0.00 0.00 174.94 175.01 2k39 s PHE 4 N -1.94 3.28 -0.41 1.37 0.08 -1.18 -1.67 117.98 117.52 2k39 s PHE 4 Ca 0.19 0.12 -0.15 0.00 0.12 0.00 0.00 56.93 57.21 2k39 s PHE 4 Cb -0.07 -2.14 0.03 0.00 -0.57 0.00 0.00 43.02 40.27 2k39 s PHE 4 CO 0.09 0.13 0.30 0.08 -0.10 0.00 0.00 175.22 175.71 2k39 s VAL 5 N 0.58 5.18 0.08 -0.44 1.01 -0.12 -1.65 120.40 125.02 2k39 s VAL 5 Ca 0.05 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2k39 s VAL 5 Cb -0.12 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 2k39 s VAL 5 CO 0.01 -0.33 0.14 -0.75 0.00 0.00 0.00 175.10 174.18 2k39 s LYS 6 N 1.66 3.14 0.08 2.72 2.20 0.63 -0.23 119.74 129.95 2k39 s LYS 6 Ca 0.05 -0.58 -0.07 0.00 -0.36 0.00 0.00 55.97 55.00 2k39 s LYS 6 Cb -0.19 -2.87 -0.01 0.00 -1.51 0.00 0.00 37.83 33.25 2k39 s LYS 6 CO 0.09 0.58 0.15 -0.08 -0.36 0.00 0.00 175.35 175.73 2k39 s THR 7 N -1.46 0.15 0.17 3.43 -1.32 -0.97 -2.52 115.64 113.13 2k39 s THR 7 Ca 0.32 -1.33 -0.09 0.00 -1.21 0.00 0.00 61.69 59.38 2k39 s THR 7 Cb -0.12 -1.41 0.02 0.00 -1.51 0.00 0.00 72.50 69.48 2k39 s THR 7 CO 0.25 -0.70 1.58 -0.07 -2.21 0.00 0.00 174.62 173.46 2k39 h LEU 8 N 2.82 1.01 0.00 9.08 4.07 -1.88 -2.82 115.31 127.59 2k39 h LEU 8 Ca -0.34 -0.36 0.00 0.00 0.08 0.00 0.00 57.88 57.26 2k39 h LEU 8 Cb 1.19 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.65 2k39 h LEU 8 CO 0.58 1.16 0.10 0.35 -1.08 0.00 0.00 178.44 179.54 2k39 n THR 9 N -4.12 0.65 0.00 0.22 -2.24 -1.26 -4.77 114.28 102.76 2k39 n THR 9 Ca 0.01 0.26 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 2k39 n THR 9 Cb 0.43 -1.26 0.00 0.00 -2.10 0.00 0.00 70.33 67.41 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 -1.07 0.64 3.69 3.38 0.00 -1.07 -5.07 105.19 105.70 2k39 n GLY 10 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2k39 n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k39 s LYS 11 N -0.94 4.45 -0.30 1.61 1.02 -1.23 -5.03 119.74 119.32 2k39 s LYS 11 Ca 0.00 1.42 0.01 0.00 0.02 0.00 0.00 55.97 57.41 2k39 s LYS 11 Cb 0.00 -3.52 0.09 0.00 -0.52 0.00 0.00 37.83 33.88 2k39 s LYS 11 CO 0.00 -0.26 0.06 0.99 -0.92 0.00 0.00 175.35 175.22 2k39 s THR 12 N 1.79 1.30 0.43 2.17 2.01 -1.26 -2.28 115.64 119.80 2k39 s THR 12 Ca 0.50 -1.57 -0.21 0.00 0.31 0.00 0.00 61.69 60.72 2k39 s THR 12 Cb -0.19 -1.91 -0.11 0.00 0.01 0.00 0.00 72.50 70.30 2k39 s THR 12 CO 0.20 -0.55 0.94 -0.63 -0.69 0.00 0.00 174.62 173.89 2k39 s ILE 13 N 1.42 4.41 -0.06 1.82 1.09 0.69 -4.97 121.20 125.59 2k39 s ILE 13 Ca 0.07 1.46 -0.01 0.00 -1.10 0.00 0.00 60.65 61.07 2k39 s ILE 13 Cb -0.18 -3.60 0.03 0.00 -1.06 0.00 0.00 42.46 37.65 2k39 s ILE 13 CO -0.17 -0.32 0.00 0.28 -0.10 0.00 0.00 174.94 174.63 2k39 s THR 14 N -2.18 0.34 0.08 2.92 -1.32 -1.26 -0.95 115.64 113.28 2k39 s THR 14 Ca 0.62 0.11 0.09 0.00 -1.21 0.00 0.00 61.69 61.29 2k39 s THR 14 Cb -0.09 -0.48 -0.03 0.00 -1.51 0.00 0.00 72.50 70.38 2k39 s THR 14 CO 0.13 0.24 -0.23 -0.76 -2.21 0.00 0.00 174.62 171.80 2k39 s LEU 15 N 1.77 2.24 -0.26 9.08 1.43 -0.67 -4.99 118.68 127.28 2k39 s LEU 15 Ca 0.02 -0.63 -0.13 0.00 -1.03 0.00 0.00 54.13 52.35 2k39 s LEU 15 Cb -0.13 -1.04 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 2k39 s LEU 15 CO -0.04 0.15 0.29 -0.70 0.23 0.00 0.00 176.35 176.28 2k39 s GLU 16 N -1.61 4.02 0.25 1.70 2.56 -1.26 -0.24 118.70 124.12 2k39 s GLU 16 Ca 0.09 -0.09 0.03 0.00 0.00 0.00 0.00 54.97 55.00 2k39 s GLU 16 Cb -0.10 -3.63 -0.05 0.00 2.00 0.00 0.00 34.13 32.35 2k39 s GLU 16 CO 0.03 -0.18 0.02 0.14 -0.56 0.00 0.00 175.26 174.71 2k39 s VAL 17 N 1.76 1.01 0.26 3.70 -7.23 0.10 -4.90 120.40 115.10 2k39 s VAL 17 Ca 0.12 -2.03 -0.00 0.00 -1.81 0.00 0.00 61.98 58.26 2k39 s VAL 17 Cb -0.15 -2.44 -0.04 0.00 0.56 0.00 0.00 36.38 34.30 2k39 s VAL 17 CO 0.09 -0.24 0.46 -1.61 -0.31 0.00 0.00 175.10 173.49 2k39 s GLU 18 N -3.89 3.52 0.63 4.82 2.02 -1.26 -0.89 118.70 123.65 2k39 s GLU 18 Ca 0.31 -0.33 0.41 0.00 0.02 0.00 0.00 54.97 55.38 2k39 s GLU 18 Cb 0.06 -2.76 2.10 0.00 0.10 0.00 0.00 34.13 33.63 2k39 s GLU 18 CO 0.10 0.30 2.25 -1.00 0.02 0.00 0.00 175.26 176.93 2k39 h PRO 19 N 1.50 0.00 -0.03 0.39 0.13 -1.94 -2.87 132.00 129.17 2k39 h PRO 19 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2k39 h PRO 19 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k39 h PRO 19 CO 0.65 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.29 2k39 n SER 20 N -3.09 1.79 -4.77 1.44 3.41 -1.26 -0.90 113.62 110.24 2k39 n SER 20 Ca -0.02 -1.60 -0.39 0.00 -0.26 0.00 0.00 58.87 56.60 2k39 n SER 20 Cb 0.15 -0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 2k39 n SER 20 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2k39 s ASP 21 N -1.97 6.33 0.27 4.04 2.15 -1.09 -4.85 116.67 121.55 2k39 s ASP 21 Ca 0.36 2.61 -0.16 0.00 0.43 0.00 0.00 52.55 55.79 2k39 s ASP 21 Cb 0.21 -2.63 -0.08 0.00 -0.30 0.00 0.00 42.92 40.11 2k39 s ASP 21 CO 0.32 -0.83 0.71 0.42 -0.17 0.00 0.00 175.17 175.62 2k39 s THR 22 N -1.28 4.66 0.58 1.71 -4.23 -1.26 -2.77 115.64 113.04 2k39 s THR 22 Ca 0.57 1.05 0.28 0.00 -1.18 0.00 0.00 61.69 62.40 2k39 s THR 22 Cb -0.37 -3.72 0.37 0.00 1.34 0.00 0.00 72.50 70.12 2k39 s THR 22 CO 0.47 0.00 2.05 0.40 -0.54 0.00 0.00 174.62 177.01 2k39 h ILE 23 N 2.33 0.51 -0.09 2.99 2.04 -1.68 -2.00 117.51 121.60 2k39 h ILE 23 Ca -0.48 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.21 2k39 h ILE 23 Cb 1.18 0.79 0.01 0.00 -0.74 0.00 0.00 36.82 38.06 2k39 h ILE 23 CO 0.66 0.00 -0.62 -0.33 0.00 0.00 0.00 178.15 177.85 2k39 h GLU 24 N 0.00 0.57 0.03 2.37 5.08 -1.93 -0.53 114.58 120.18 2k39 h GLU 24 Ca 0.13 -0.50 -0.00 0.00 -1.00 0.00 0.00 59.36 57.99 2k39 h GLU 24 Cb 0.67 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2k39 h GLU 24 CO -0.00 1.13 -0.02 -0.97 -1.00 0.00 0.00 179.01 178.15 2k39 h ASN 25 N 0.19 -0.04 -0.50 1.42 -1.24 -1.81 -0.26 115.58 113.33 2k39 h ASN 25 Ca -0.05 -0.14 0.13 0.00 0.71 0.00 0.00 56.30 56.94 2k39 h ASN 25 Cb 1.28 0.01 -0.02 0.00 0.73 0.00 0.00 38.32 40.31 2k39 h ASN 25 CO 0.13 0.12 0.35 0.58 -1.29 0.00 0.00 177.43 177.32 2k39 h VAL 26 N -0.20 0.80 0.00 2.57 2.07 -1.44 -2.23 116.25 117.82 2k39 h VAL 26 Ca -0.00 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2k39 h VAL 26 Cb 0.18 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 2k39 h VAL 26 CO 0.01 0.02 0.00 0.11 0.02 0.00 0.00 177.57 177.73 2k39 h LYS 27 N 0.12 0.00 0.00 1.57 1.57 0.65 -2.18 116.57 118.30 2k39 h LYS 27 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2k39 h LYS 27 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 2k39 h LYS 27 CO -0.03 0.00 -1.14 0.00 -0.57 0.00 0.00 179.45 177.71 2k39 n ALA 28 N -1.95 2.56 0.13 3.86 0.00 -0.94 -3.69 120.51 120.47 2k39 n ALA 28 Ca 0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 53.44 53.19 2k39 n ALA 28 Cb 0.41 -1.06 0.13 0.00 0.00 0.00 0.00 19.45 18.93 2k39 n ALA 28 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2k39 h LYS 29 N 0.00 0.00 -0.06 0.00 1.57 -0.82 -2.26 116.57 115.01 2k39 h LYS 29 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 2k39 h LYS 29 Cb 1.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 2k39 h LYS 29 CO 0.00 0.67 -0.21 0.82 -0.57 0.00 0.00 179.45 180.16 2k39 h ILE 30 N 0.00 1.18 0.26 1.86 2.04 -1.62 -3.27 117.51 117.96 2k39 h ILE 30 Ca -0.01 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.01 2k39 h ILE 30 Cb 1.20 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 2k39 h ILE 30 CO 0.09 0.25 -0.12 -0.61 0.00 0.00 0.00 178.15 177.75 2k39 h GLN 31 N 0.08 -0.33 -1.35 2.37 4.15 -1.49 0.34 115.11 118.89 2k39 h GLN 31 Ca 0.01 0.02 0.44 0.00 0.77 0.00 0.00 58.65 59.89 2k39 h GLN 31 Cb 0.42 0.08 -0.10 0.00 0.21 0.00 0.00 27.48 28.08 2k39 h GLN 31 CO 0.03 -0.04 0.91 -3.47 -1.93 0.00 0.00 178.83 174.33 2k39 n ASP 32 N -5.12 0.12 -0.09 -0.69 2.03 -1.02 -1.09 116.55 110.70 2k39 n ASP 32 Ca -0.09 1.08 -0.10 0.00 0.52 0.00 0.00 54.79 56.20 2k39 n ASP 32 Cb 0.24 -0.53 -0.04 0.00 -0.72 0.00 0.00 41.12 40.07 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 -4.17 0.50 0.10 -0.67 4.76 -1.01 -4.79 118.16 112.88 2k39 n LYS 33 Ca 0.36 0.42 0.09 0.00 -2.87 0.00 0.00 58.31 56.31 2k39 n LYS 33 Cb 1.47 -1.61 -0.00 0.00 -1.84 0.00 0.00 35.03 33.05 2k39 n LYS 33 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2k39 h GLU 34 N -1.00 0.00 0.00 1.97 4.39 -0.50 -3.49 114.58 115.96 2k39 h GLU 34 Ca -0.10 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.60 2k39 h GLU 34 Cb 0.84 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2k39 h GLU 34 CO -0.06 0.06 0.00 0.41 -1.16 0.00 0.00 179.01 178.26 2k39 n GLY 35 N 1.22 0.67 3.86 -3.84 0.00 -0.25 -5.06 105.19 101.79 2k39 n GLY 35 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.40 5.21 0.15 -0.61 1.01 -1.26 -5.03 121.20 118.27 2k39 s ILE 36 Ca 0.00 0.55 -0.29 0.00 0.00 0.00 0.00 60.65 60.90 2k39 s ILE 36 Cb 0.00 -3.60 -0.07 0.00 0.01 0.00 0.00 42.46 38.81 2k39 s ILE 36 CO 0.00 0.55 0.93 -2.16 0.00 0.00 0.00 174.94 174.26 2k39 s PRO 37 N -1.20 4.72 0.57 2.79 0.04 -1.26 -4.23 135.00 136.44 2k39 s PRO 37 Ca 0.22 1.42 0.35 0.00 0.04 0.00 0.00 61.00 63.03 2k39 s PRO 37 Cb -0.15 -3.34 1.65 0.00 0.04 0.00 0.00 34.50 32.70 2k39 s PRO 37 CO 0.11 0.33 2.10 -1.00 0.04 0.00 0.00 177.00 178.58 2k39 h PRO 38 N 5.08 0.00 0.00 0.56 0.13 -1.98 -2.83 132.00 132.96 2k39 h PRO 38 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2k39 h PRO 38 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2k39 h PRO 38 CO 0.70 0.04 0.00 -0.40 -0.23 0.00 0.00 178.00 178.11 2k39 n ASP 39 N -3.22 0.00 0.04 1.44 5.75 -1.26 -1.31 116.55 117.99 2k39 n ASP 39 Ca -0.01 -1.28 0.11 0.00 -0.01 0.00 0.00 54.79 53.60 2k39 n ASP 39 Cb 0.24 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.25 2k39 n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k39 n GLN 40 N -0.76 0.57 -3.56 0.11 6.02 -1.07 -4.68 117.38 114.00 2k39 n GLN 40 Ca 0.11 -0.04 -0.37 0.00 -0.01 0.00 0.00 57.00 56.68 2k39 n GLN 40 Cb 0.05 -1.65 -0.09 0.00 1.02 0.00 0.00 30.24 29.57 2k39 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2k39 s GLN 41 N -3.40 4.11 -0.08 -1.09 -1.52 -0.43 -0.97 119.66 116.28 2k39 s GLN 41 Ca -0.03 -0.10 0.02 0.00 -1.95 0.00 0.00 55.36 53.29 2k39 s GLN 41 Cb 0.12 -3.54 0.02 0.00 -0.22 0.00 0.00 33.01 29.39 2k39 s GLN 41 CO 0.85 0.02 -0.12 0.50 -0.25 0.00 0.00 175.29 176.29 2k39 s ARG 42 N 1.16 1.75 -0.15 2.91 3.00 -0.26 -4.54 118.95 122.81 2k39 s ARG 42 Ca 0.12 -0.41 -0.07 0.00 -1.00 0.00 0.00 55.73 54.37 2k39 s ARG 42 Cb -0.14 -1.51 -0.04 0.00 0.00 0.00 0.00 34.95 33.26 2k39 s ARG 42 CO 0.06 -0.04 0.10 -0.51 0.00 0.00 0.00 175.30 174.91 2k39 s LEU 43 N 0.90 4.09 0.15 -0.88 1.43 -1.26 -0.27 118.68 122.84 2k39 s LEU 43 Ca -0.10 0.26 0.06 0.00 -1.03 0.00 0.00 54.13 53.33 2k39 s LEU 43 Cb -0.15 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 2k39 s LEU 43 CO 0.01 0.28 -0.14 -0.63 0.23 0.00 0.00 176.35 176.10 2k39 s ILE 44 N -0.29 1.44 0.00 -0.59 1.01 -0.78 -1.89 121.20 120.09 2k39 s ILE 44 Ca 0.10 -1.89 0.00 0.00 0.00 0.00 0.00 60.65 58.85 2k39 s ILE 44 Cb -0.12 -1.72 0.00 0.00 0.01 0.00 0.00 42.46 40.63 2k39 s ILE 44 CO 0.01 -0.50 0.00 0.33 0.00 0.00 0.00 174.94 174.79 2k39 n PHE 45 N 0.20 0.00 -0.94 3.97 7.35 -0.82 -0.55 117.46 126.68 2k39 n PHE 45 Ca -0.13 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.43 2k39 n PHE 45 Cb 0.58 0.00 -0.04 0.00 0.35 0.00 0.00 39.48 40.37 2k39 n PHE 45 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k39 n ALA 46 N -3.00 5.41 0.00 3.13 0.00 -1.26 -4.46 120.51 120.32 2k39 n ALA 46 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 53.44 51.91 2k39 n ALA 46 Cb 0.00 -1.67 0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 1.32 3.00 3.68 0.00 0.00 -1.26 -5.08 105.19 106.86 2k39 n GLY 47 Ca 0.29 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.59 4.32 -0.18 1.61 1.02 -1.26 -5.04 119.74 119.62 2k39 s LYS 48 Ca 0.00 0.82 -0.29 0.00 0.02 0.00 0.00 55.97 56.52 2k39 s LYS 48 Cb 0.00 -3.53 -0.01 0.00 -0.52 0.00 0.00 37.83 33.78 2k39 s LYS 48 CO 0.00 -0.15 1.22 -0.65 -0.92 0.00 0.00 175.35 174.85 2k39 s GLN 49 N 1.55 4.23 -0.16 1.68 1.11 -1.26 -1.94 119.66 124.86 2k39 s GLN 49 Ca 0.35 1.59 -0.18 0.00 0.01 0.00 0.00 55.36 57.13 2k39 s GLN 49 Cb -0.17 -3.74 -0.04 0.00 -1.01 0.00 0.00 33.01 28.05 2k39 s GLN 49 CO 0.14 -0.70 0.48 -0.51 0.01 0.00 0.00 175.29 174.70 2k39 s LEU 50 N 3.47 4.22 0.44 2.90 1.43 -0.80 -5.01 118.68 125.33 2k39 s LEU 50 Ca 0.53 0.72 -0.21 0.00 -1.03 0.00 0.00 54.13 54.13 2k39 s LEU 50 Cb -0.20 -2.67 -0.10 0.00 0.03 0.00 0.00 46.19 43.25 2k39 s LEU 50 CO 0.13 -0.07 0.99 -0.70 0.23 0.00 0.00 176.35 176.93 2k39 s GLU 51 N 1.05 4.09 0.10 1.70 2.56 -1.26 -4.68 118.70 122.27 2k39 s GLU 51 Ca 0.24 1.24 -0.31 0.00 0.00 0.00 0.00 54.97 56.14 2k39 s GLU 51 Cb -0.15 -2.20 -0.09 0.00 2.00 0.00 0.00 34.13 33.69 2k39 s GLU 51 CO 0.09 -0.17 1.62 -0.51 -0.56 0.00 0.00 175.26 175.74 2k39 s ASP 52 N -2.05 6.60 0.00 -1.70 1.01 -1.26 -3.42 116.67 115.85 2k39 s ASP 52 Ca 0.63 2.53 0.00 0.00 0.71 0.00 0.00 52.55 56.42 2k39 s ASP 52 Cb -0.13 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.23 2k39 s ASP 52 CO 0.17 -0.87 0.00 0.61 0.21 0.00 0.00 175.17 175.29 2k39 n GLY 53 N 3.91 3.47 3.80 0.21 0.00 -1.26 -4.99 105.19 110.33 2k39 n GLY 53 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.95 3.06 0.84 1.61 1.81 -1.22 -4.75 118.95 119.35 2k39 s ARG 54 Ca 0.00 1.18 -0.06 0.00 -1.72 0.00 0.00 55.73 55.12 2k39 s ARG 54 Cb 0.00 -2.00 0.18 0.00 -0.45 0.00 0.00 34.95 32.68 2k39 s ARG 54 CO 0.00 -1.01 1.14 0.25 -0.68 0.00 0.00 175.30 175.00 2k39 n THR 55 N -2.46 0.00 0.20 0.02 -2.24 -1.26 -1.94 114.28 106.60 2k39 n THR 55 Ca 0.09 -1.39 0.09 0.00 -2.27 0.00 0.00 64.05 60.57 2k39 n THR 55 Cb 0.53 -1.11 0.24 0.00 -2.10 0.00 0.00 70.33 67.90 2k39 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2k39 h LEU 56 N 0.00 0.00 -0.63 3.22 3.38 -1.41 -3.23 115.31 116.64 2k39 h LEU 56 Ca -0.37 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.53 2k39 h LEU 56 Cb 1.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 2k39 h LEU 56 CO 0.34 0.20 0.13 -1.28 0.09 0.00 0.00 178.44 177.93 2k39 h SER 57 N 0.00 0.98 -0.17 -0.43 0.87 -1.26 -1.95 113.55 111.59 2k39 h SER 57 Ca -0.00 -0.24 0.05 0.00 -1.23 0.00 0.00 61.79 60.37 2k39 h SER 57 Cb 1.01 -0.26 -0.06 0.00 -0.44 0.00 0.00 62.40 62.65 2k39 h SER 57 CO 0.03 0.97 -0.27 0.44 -0.53 0.00 0.00 176.83 177.47 2k39 h ASP 58 N 0.94 -0.83 -0.20 6.23 3.32 -1.85 -2.49 116.42 121.53 2k39 h ASP 58 Ca 0.20 0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.38 2k39 h ASP 58 Cb 0.39 0.37 0.00 0.00 0.22 0.00 0.00 39.33 40.31 2k39 h ASP 58 CO 0.01 -0.31 0.00 -1.22 -1.72 0.00 0.00 179.24 176.00 2k39 n TYR 59 N -5.38 0.24 -2.20 4.55 4.01 -1.24 -4.97 117.16 112.18 2k39 n TYR 59 Ca -0.02 -0.12 -0.16 0.00 -0.16 0.00 0.00 57.90 57.44 2k39 n TYR 59 Cb 0.30 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.31 2k39 n TYR 59 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2k39 n ASN 60 N 0.85 -4.82 -4.72 7.72 6.94 -0.94 -5.01 115.26 115.29 2k39 n ASN 60 Ca 0.17 0.04 -0.42 0.00 -0.02 0.00 0.00 54.58 54.35 2k39 n ASN 60 Cb 0.47 -3.91 -0.03 0.00 -2.36 0.00 0.00 39.78 33.95 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2k39 s ILE 61 N -2.78 4.09 0.45 1.53 1.01 -0.76 -5.03 121.20 119.71 2k39 s ILE 61 Ca 0.00 1.56 0.03 0.00 0.00 0.00 0.00 60.65 62.24 2k39 s ILE 61 Cb 0.00 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.44 2k39 s ILE 61 CO 0.00 0.16 0.05 -1.10 0.00 0.00 0.00 174.94 174.05 2k39 s GLN 62 N 0.71 2.03 0.06 2.79 -0.21 -1.26 -4.55 119.66 119.24 2k39 s GLN 62 Ca 0.56 -2.25 -0.35 0.00 0.02 0.00 0.00 55.36 53.33 2k39 s GLN 62 Cb -0.28 -1.16 -0.14 0.00 1.00 0.00 0.00 33.01 32.42 2k39 s GLN 62 CO 0.30 -0.36 1.59 0.36 -2.12 0.00 0.00 175.29 175.07 2k39 n LYS 63 N -1.06 1.83 -1.29 2.91 2.85 -1.26 -1.55 118.16 120.60 2k39 n LYS 63 Ca -0.12 0.66 -0.10 0.00 -1.05 0.00 0.00 58.31 57.71 2k39 n LYS 63 Cb 0.66 -2.41 -0.04 0.00 -0.65 0.00 0.00 35.03 32.59 2k39 n LYS 63 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2k39 n GLU 64 N 3.99 -1.45 -2.51 -1.58 2.13 -0.43 -5.00 120.64 115.79 2k39 n GLU 64 Ca 0.19 0.82 -0.43 0.00 0.66 0.00 0.00 57.16 58.40 2k39 n GLU 64 Cb 0.25 -5.08 -0.02 0.00 0.27 0.00 0.00 31.44 26.85 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2k39 s SER 65 N -2.45 7.06 -0.08 4.31 0.01 -0.59 -4.77 113.70 117.19 2k39 s SER 65 Ca 0.00 1.69 -0.23 0.00 1.31 0.00 0.00 55.95 58.72 2k39 s SER 65 Cb 0.00 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 2k39 s SER 65 CO 0.00 -0.61 0.68 -0.89 0.41 0.00 0.00 173.24 172.83 2k39 s THR 66 N 2.60 5.05 -0.16 1.44 2.01 -1.26 -3.08 115.64 122.24 2k39 s THR 66 Ca 0.53 1.39 -0.08 0.00 0.31 0.00 0.00 61.69 63.84 2k39 s THR 66 Cb -0.22 -4.02 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 2k39 s THR 66 CO 0.18 0.24 0.12 -0.76 -0.69 0.00 0.00 174.62 173.70 2k39 s LEU 67 N 0.90 4.18 0.34 4.42 2.01 -0.66 -4.76 118.68 125.12 2k39 s LEU 67 Ca 0.36 0.29 -0.14 0.00 0.01 0.00 0.00 54.13 54.65 2k39 s LEU 67 Cb -0.17 -2.05 -0.08 0.00 0.01 0.00 0.00 46.19 43.90 2k39 s LEU 67 CO 0.17 0.27 0.74 -2.28 1.01 0.00 0.00 176.35 176.26 2k39 s HIS 68 N -0.21 3.40 -0.16 0.29 5.65 0.29 -0.27 115.29 124.27 2k39 s HIS 68 Ca 0.10 1.16 -0.02 0.00 0.25 0.00 0.00 55.06 56.55 2k39 s HIS 68 Cb -0.12 -2.50 0.05 0.00 -1.18 0.00 0.00 32.58 28.83 2k39 s HIS 68 CO 0.01 0.04 0.02 -1.17 -0.65 0.00 0.00 174.74 172.99 2k39 s LEU 69 N -3.22 1.09 0.00 8.88 2.96 -1.05 -1.87 118.68 125.48 2k39 s LEU 69 Ca 0.53 -0.64 0.02 0.00 -0.22 0.00 0.00 54.13 53.82 2k39 s LEU 69 Cb -0.10 -0.59 0.02 0.00 0.50 0.00 0.00 46.19 46.01 2k39 s LEU 69 CO 0.21 -0.27 0.13 1.33 -1.32 0.00 0.00 176.35 176.43 2k39 n VAL 70 N 5.05 0.00 -3.16 1.68 0.24 0.63 -4.80 118.33 117.98 2k39 n VAL 70 Ca -0.09 -1.82 -0.39 0.00 -2.04 0.00 0.00 64.34 60.01 2k39 n VAL 70 Cb 0.48 0.17 -0.06 0.00 -1.47 0.00 0.00 33.84 32.96 2k39 n VAL 70 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2k39 s LEU 71 N 0.00 4.53 -0.08 1.34 1.43 -1.26 -1.10 118.68 123.54 2k39 s LEU 71 Ca 0.10 1.37 -0.30 0.00 -1.03 0.00 0.00 54.13 54.27 2k39 s LEU 71 Cb -0.01 -3.03 -0.02 0.00 0.03 0.00 0.00 46.19 43.15 2k39 s LEU 71 CO 0.06 0.21 1.15 -0.60 0.23 0.00 0.00 176.35 177.40 2k39 s ARG 72 N -0.91 4.36 -0.44 1.70 3.52 -0.14 -4.49 118.95 122.55 2k39 s ARG 72 Ca 0.32 1.59 0.02 0.00 -0.13 0.00 0.00 55.73 57.53 2k39 s ARG 72 Cb -0.20 -3.56 0.13 0.00 -1.56 0.00 0.00 34.95 29.75 2k39 s ARG 72 CO 0.21 -0.43 0.21 -0.51 -0.81 0.00 0.00 175.30 173.97 2k39 s LEU 73 N 2.24 3.24 0.00 -0.88 1.43 -1.26 -4.88 118.68 118.57 2k39 s LEU 73 Ca 0.53 -2.58 0.00 0.00 -1.03 0.00 0.00 54.13 51.05 2k39 s LEU 73 Cb -0.22 -1.23 0.00 0.00 0.03 0.00 0.00 46.19 44.77 2k39 s LEU 73 CO 0.20 -0.28 0.00 -1.14 0.23 0.00 0.00 176.35 175.36 2k39 n ARG 74 N 3.63 0.00 -4.55 1.70 0.63 -1.26 -4.88 116.66 111.92 2k39 n ARG 74 Ca 0.06 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.69 2k39 n ARG 74 Cb 0.35 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 33.19 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 0.00 3.50 0.58 5.14 0.00 -1.26 -5.21 105.19 107.94 2k39 n GLY 75 Ca 0.00 -2.31 0.07 0.00 0.00 0.00 0.00 46.02 43.79 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93