#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 2.09 0.39 2.12 -0.21 -1.26 -0.02 119.66 122.77 2k39 s GLN 2 Ca 0.00 -0.97 0.04 0.00 0.02 0.00 0.00 55.36 54.45 2k39 s GLN 2 Cb 0.00 -2.20 -0.03 0.00 1.00 0.00 0.00 33.01 31.78 2k39 s GLN 2 CO 0.00 0.54 0.16 0.96 -2.12 0.00 0.00 175.29 174.83 2k39 s ILE 3 N -0.94 0.46 0.10 1.08 -4.36 0.95 -0.39 121.20 118.11 2k39 s ILE 3 Ca 0.15 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.62 2k39 s ILE 3 Cb -0.11 -2.38 -0.03 0.00 1.25 0.00 0.00 42.46 41.19 2k39 s ILE 3 CO 0.06 0.00 -0.22 -0.36 0.24 0.00 0.00 174.94 174.66 2k39 s PHE 4 N -3.28 1.86 -0.21 1.37 0.08 -0.35 -1.18 117.98 116.27 2k39 s PHE 4 Ca 0.28 -0.41 -0.01 0.00 0.12 0.00 0.00 56.93 56.91 2k39 s PHE 4 Cb 0.03 -1.03 0.05 0.00 -0.57 0.00 0.00 43.02 41.50 2k39 s PHE 4 CO 0.17 0.21 -0.03 0.14 -0.10 0.00 0.00 175.22 175.61 2k39 s VAL 5 N -1.11 1.15 -0.25 -0.44 -7.23 0.56 -0.79 120.40 112.29 2k39 s VAL 5 Ca 0.07 -0.89 -0.29 0.00 -1.81 0.00 0.00 61.98 59.07 2k39 s VAL 5 Cb -0.10 -1.46 -0.01 0.00 0.56 0.00 0.00 36.38 35.37 2k39 s VAL 5 CO 0.04 -0.07 1.47 -0.75 -0.31 0.00 0.00 175.10 175.49 2k39 s LYS 6 N 1.58 3.86 0.54 4.82 2.20 0.48 -1.01 119.74 132.22 2k39 s LYS 6 Ca -0.03 1.49 0.02 0.00 -0.36 0.00 0.00 55.97 57.09 2k39 s LYS 6 Cb -0.17 -3.96 0.03 0.00 -1.51 0.00 0.00 37.83 32.22 2k39 s LYS 6 CO -0.07 -1.20 0.76 0.95 -0.36 0.00 0.00 175.35 175.43 2k39 s THR 7 N 4.79 2.68 -0.41 3.43 -4.23 0.19 -2.05 115.64 120.04 2k39 s THR 7 Ca 0.64 -0.71 0.26 0.00 -1.18 0.00 0.00 61.69 60.71 2k39 s THR 7 Cb -0.21 -2.98 0.28 0.00 1.34 0.00 0.00 72.50 70.93 2k39 s THR 7 CO 0.26 0.00 1.77 -0.07 -0.54 0.00 0.00 174.62 176.04 2k39 h LEU 8 N 0.12 0.00 -0.58 4.79 4.07 -1.86 0.79 115.31 122.64 2k39 h LEU 8 Ca -0.41 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.39 2k39 h LEU 8 Cb 1.29 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.02 2k39 h LEU 8 CO 0.51 0.00 -0.69 0.71 -1.08 0.00 0.00 178.44 177.89 2k39 h THR 9 N 0.00 1.45 0.00 0.22 1.35 -1.96 -3.48 112.91 110.49 2k39 h THR 9 Ca 0.00 -2.26 0.00 0.00 -0.55 0.00 0.00 66.41 63.60 2k39 h THR 9 Cb 0.46 2.20 0.00 0.00 -1.73 0.00 0.00 68.15 69.09 2k39 h THR 9 CO 0.00 0.65 0.00 0.61 -0.25 0.00 0.00 175.52 176.53 2k39 n GLY 10 N 0.45 0.92 3.76 5.82 0.00 0.27 -5.13 105.19 111.29 2k39 n GLY 10 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.42 3.55 -0.32 1.61 1.02 -1.25 -4.62 119.74 119.31 2k39 s LYS 11 Ca 0.00 1.92 -0.00 0.00 0.02 0.00 0.00 55.97 57.91 2k39 s LYS 11 Cb 0.00 -2.35 0.07 0.00 -0.52 0.00 0.00 37.83 35.03 2k39 s LYS 11 CO 0.00 -0.76 0.02 0.99 -0.92 0.00 0.00 175.35 174.68 2k39 s THR 12 N -1.47 2.76 -0.08 2.17 2.01 -1.26 0.57 115.64 120.34 2k39 s THR 12 Ca 0.66 -1.70 -0.08 0.00 0.31 0.00 0.00 61.69 60.88 2k39 s THR 12 Cb -0.32 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.43 2k39 s THR 12 CO 0.39 -0.27 0.20 -0.63 -0.69 0.00 0.00 174.62 173.62 2k39 s ILE 13 N 1.15 5.40 0.17 1.82 -1.09 -0.18 -4.90 121.20 123.57 2k39 s ILE 13 Ca -0.01 0.30 -0.30 0.00 -2.23 0.00 0.00 60.65 58.41 2k39 s ILE 13 Cb -0.20 -3.48 -0.07 0.00 -1.58 0.00 0.00 42.46 37.13 2k39 s ILE 13 CO -0.03 0.58 0.98 -0.89 -1.23 0.00 0.00 174.94 174.34 2k39 s THR 14 N -1.07 4.23 -0.02 2.92 2.01 -1.26 -0.32 115.64 122.13 2k39 s THR 14 Ca 0.18 2.00 -0.01 0.00 0.31 0.00 0.00 61.69 64.17 2k39 s THR 14 Cb -0.13 -4.27 0.01 0.00 0.01 0.00 0.00 72.50 68.12 2k39 s THR 14 CO 0.07 0.38 0.03 -0.22 -0.69 0.00 0.00 174.62 174.19 2k39 s LEU 15 N -0.50 1.54 -0.18 4.42 1.98 -0.33 -4.93 118.68 120.68 2k39 s LEU 15 Ca 0.45 0.06 -0.07 0.00 -2.89 0.00 0.00 54.13 51.68 2k39 s LEU 15 Cb -0.25 0.05 -0.04 0.00 0.66 0.00 0.00 46.19 46.60 2k39 s LEU 15 CO 0.32 -0.06 0.07 -0.70 -1.89 0.00 0.00 176.35 174.09 2k39 s GLU 16 N 0.46 3.92 0.00 1.98 2.56 -1.26 -0.04 118.70 126.33 2k39 s GLU 16 Ca -0.04 -0.32 0.00 0.00 0.00 0.00 0.00 54.97 54.61 2k39 s GLU 16 Cb -0.05 -3.21 0.00 0.00 2.00 0.00 0.00 34.13 32.86 2k39 s GLU 16 CO -0.01 0.33 0.00 1.33 -0.56 0.00 0.00 175.26 176.34 2k39 n VAL 17 N 3.37 0.00 -3.75 3.70 0.24 0.97 -4.98 118.33 117.88 2k39 n VAL 17 Ca -0.17 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.00 2k39 n VAL 17 Cb 0.52 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.79 2k39 n VAL 17 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2k39 s GLU 18 N -0.68 0.40 0.61 7.34 2.56 -1.26 -1.59 118.70 126.08 2k39 s GLU 18 Ca 0.00 0.50 0.36 0.00 0.00 0.00 0.00 54.97 55.82 2k39 s GLU 18 Cb 0.00 0.18 2.00 0.00 2.00 0.00 0.00 34.13 38.30 2k39 s GLU 18 CO 0.00 -0.06 2.27 -1.00 -0.56 0.00 0.00 175.26 175.91 2k39 h PRO 19 N 5.71 0.00 0.00 4.30 0.13 -1.94 -2.84 132.00 137.36 2k39 h PRO 19 Ca -0.27 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.70 2k39 h PRO 19 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2k39 h PRO 19 CO 0.29 0.02 -1.44 0.43 -0.23 0.00 0.00 178.00 177.07 2k39 n SER 20 N -3.48 0.79 -4.58 1.44 7.64 -1.26 -0.66 113.62 113.50 2k39 n SER 20 Ca -0.03 0.34 -0.41 0.00 1.01 0.00 0.00 58.87 59.78 2k39 n SER 20 Cb 0.11 0.30 -0.03 0.00 -1.01 0.00 0.00 64.21 63.58 2k39 n SER 20 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k39 s ASP 21 N -5.67 5.88 0.53 6.43 2.15 -1.07 -4.77 116.67 120.14 2k39 s ASP 21 Ca -0.03 0.72 -0.19 0.00 0.43 0.00 0.00 52.55 53.48 2k39 s ASP 21 Cb 0.09 -2.53 -0.09 0.00 -0.30 0.00 0.00 42.92 40.08 2k39 s ASP 21 CO 0.81 -1.82 0.58 0.35 -0.17 0.00 0.00 175.17 174.92 2k39 n THR 22 N 7.16 2.21 -0.35 1.71 -2.24 -1.26 -4.60 114.28 116.91 2k39 n THR 22 Ca 0.18 -0.50 0.01 0.00 -2.27 0.00 0.00 64.05 61.48 2k39 n THR 22 Cb 0.49 -0.70 0.17 0.00 -2.10 0.00 0.00 70.33 68.19 2k39 n THR 22 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2k39 h ILE 23 N 0.46 1.14 -0.56 2.28 2.04 -1.73 -0.65 117.51 120.49 2k39 h ILE 23 Ca -0.45 -0.41 0.11 0.00 1.00 0.00 0.00 64.86 65.11 2k39 h ILE 23 Cb 1.39 -0.17 -0.11 0.00 -0.74 0.00 0.00 36.82 37.20 2k39 h ILE 23 CO 0.49 0.22 -0.25 -0.33 0.00 0.00 0.00 178.15 178.28 2k39 h GLU 24 N 1.20 -0.10 0.00 2.37 5.08 -1.90 -0.47 114.58 120.76 2k39 h GLU 24 Ca 0.40 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.72 2k39 h GLU 24 Cb 0.06 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2k39 h GLU 24 CO -0.14 -0.07 -0.24 -0.97 -1.00 0.00 0.00 179.01 176.60 2k39 h ASN 25 N -0.11 0.00 0.30 1.42 -1.24 -1.49 -3.22 115.58 111.25 2k39 h ASN 25 Ca 0.25 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.26 2k39 h ASN 25 Cb 0.51 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.54 2k39 h ASN 25 CO -0.63 0.24 -0.29 0.58 -1.29 0.00 0.00 177.43 176.04 2k39 h VAL 26 N 0.00 0.39 -0.95 2.57 2.07 -0.07 -3.10 116.25 117.16 2k39 h VAL 26 Ca -0.00 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.82 2k39 h VAL 26 Cb 0.67 0.39 -0.16 0.00 -1.52 0.00 0.00 31.29 30.67 2k39 h VAL 26 CO 0.03 0.00 0.36 0.11 0.02 0.00 0.00 177.57 178.09 2k39 h LYS 27 N -0.62 0.18 -0.15 1.57 1.57 -1.45 -2.38 116.57 115.28 2k39 h LYS 27 Ca -0.01 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 2k39 h LYS 27 Cb 0.56 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 2k39 h LYS 27 CO -0.05 0.12 -0.22 0.00 -0.57 0.00 0.00 179.45 178.73 2k39 h ALA 28 N 1.87 1.35 -0.08 3.86 0.00 -1.59 -0.91 119.26 123.76 2k39 h ALA 28 Ca 0.67 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 55.19 2k39 h ALA 28 Cb 1.49 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2k39 h ALA 28 CO -0.70 0.44 -0.43 0.87 0.00 0.00 0.00 179.25 179.44 2k39 h LYS 29 N 0.25 0.18 -0.17 0.00 1.57 -1.44 -2.04 116.57 114.92 2k39 h LYS 29 Ca 0.04 -0.09 -0.22 0.00 -1.87 0.00 0.00 60.65 58.52 2k39 h LYS 29 Cb 0.52 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.84 2k39 h LYS 29 CO 0.04 0.58 -0.74 0.82 -0.57 0.00 0.00 179.45 179.57 2k39 h ILE 30 N 0.15 1.28 -0.98 1.86 2.04 -1.37 -2.51 117.51 117.99 2k39 h ILE 30 Ca 0.01 -1.94 0.20 0.00 1.00 0.00 0.00 64.86 64.14 2k39 h ILE 30 Cb 0.83 1.95 -0.09 0.00 -0.74 0.00 0.00 36.82 38.77 2k39 h ILE 30 CO 0.06 0.62 0.62 -0.61 0.00 0.00 0.00 178.15 178.84 2k39 h GLN 31 N 0.54 0.58 -0.20 2.37 4.15 -1.03 0.22 115.11 121.74 2k39 h GLN 31 Ca -0.05 -0.04 -0.19 0.00 0.77 0.00 0.00 58.65 59.15 2k39 h GLN 31 Cb 1.37 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.93 2k39 h GLN 31 CO 0.16 0.39 -0.63 0.22 -1.93 0.00 0.00 178.83 177.03 2k39 h ASP 32 N 0.60 0.80 0.04 -0.69 3.58 -1.18 0.48 116.42 120.06 2k39 h ASP 32 Ca 0.54 -0.46 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 2k39 h ASP 32 Cb 1.06 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.88 2k39 h ASP 32 CO -0.30 1.23 -0.02 0.11 -2.88 0.00 0.00 179.24 177.39 2k39 h LYS 33 N 0.52 -0.05 0.00 0.28 1.79 -1.13 -3.43 116.57 114.55 2k39 h LYS 33 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2k39 h LYS 33 Cb 1.22 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2k39 h LYS 33 CO 0.13 0.61 0.00 0.39 -1.08 0.00 0.00 179.45 179.49 2k39 n GLU 34 N -4.76 -0.28 0.00 3.15 -0.58 0.75 -5.06 120.64 113.87 2k39 n GLU 34 Ca -0.08 -0.16 0.00 0.00 -0.42 0.00 0.00 57.16 56.50 2k39 n GLU 34 Cb 0.33 -0.65 0.00 0.00 -0.57 0.00 0.00 31.44 30.55 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 0.01 3.24 3.66 0.62 0.00 0.16 -4.91 105.19 107.96 2k39 n GLY 35 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.52 4.04 0.34 -0.61 1.01 -1.26 -4.78 121.20 117.42 2k39 s ILE 36 Ca 0.00 1.26 -0.27 0.00 0.00 0.00 0.00 60.65 61.64 2k39 s ILE 36 Cb 0.00 -3.81 -0.09 0.00 0.01 0.00 0.00 42.46 38.56 2k39 s ILE 36 CO 0.00 -0.11 1.14 -2.16 0.00 0.00 0.00 174.94 173.81 2k39 s PRO 37 N 3.68 4.34 0.27 2.79 0.04 -1.26 -3.25 135.00 141.60 2k39 s PRO 37 Ca 0.61 1.83 0.10 0.00 0.04 0.00 0.00 61.00 63.57 2k39 s PRO 37 Cb -0.26 -2.91 0.85 0.00 0.04 0.00 0.00 34.50 32.22 2k39 s PRO 37 CO 0.20 -0.07 1.22 -2.30 0.04 0.00 0.00 177.00 176.09 2k39 n PRO 38 N 0.58 -0.05 0.28 0.56 -0.02 -1.26 -0.43 135.00 134.65 2k39 n PRO 38 Ca 0.02 1.11 0.18 0.00 -2.02 0.00 0.00 63.50 62.78 2k39 n PRO 38 Cb 0.46 -1.89 0.96 0.00 -0.02 0.00 0.00 33.50 33.01 2k39 n PRO 38 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2k39 h ASP 39 N 0.00 0.00 -0.00 2.55 3.58 -1.97 -2.40 116.42 118.17 2k39 h ASP 39 Ca 0.58 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.03 2k39 h ASP 39 Cb 1.40 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.45 2k39 h ASP 39 CO -0.65 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 175.71 2k39 n GLN 40 N -2.76 -0.43 -3.09 0.28 6.02 0.42 -4.86 117.38 112.96 2k39 n GLN 40 Ca -0.02 -0.66 -0.32 0.00 -0.01 0.00 0.00 57.00 55.99 2k39 n GLN 40 Cb 0.10 -1.01 -0.05 0.00 1.02 0.00 0.00 30.24 30.29 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 -0.17 3.93 -0.05 -1.09 -0.21 -0.91 0.50 119.66 121.66 2k39 s GLN 41 Ca 0.01 0.58 0.01 0.00 0.02 0.00 0.00 55.36 55.98 2k39 s GLN 41 Cb 0.00 -2.44 0.02 0.00 1.00 0.00 0.00 33.01 31.60 2k39 s GLN 41 CO 0.01 0.12 -0.07 1.03 -2.12 0.00 0.00 175.29 174.26 2k39 s ARG 42 N -3.20 1.11 -0.17 2.91 0.52 -0.16 -4.69 118.95 115.28 2k39 s ARG 42 Ca 0.53 -0.19 -0.04 0.00 -0.52 0.00 0.00 55.73 55.50 2k39 s ARG 42 Cb -0.10 -1.04 -0.03 0.00 0.52 0.00 0.00 34.95 34.30 2k39 s ARG 42 CO 0.21 -0.07 -0.02 -0.51 0.02 0.00 0.00 175.30 174.94 2k39 s LEU 43 N 0.92 3.33 -0.15 2.53 1.43 -1.26 -1.59 118.68 123.88 2k39 s LEU 43 Ca -0.11 -0.11 -0.02 0.00 -1.03 0.00 0.00 54.13 52.87 2k39 s LEU 43 Cb -0.15 -1.82 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 2k39 s LEU 43 CO 0.01 0.16 -0.09 -0.63 0.23 0.00 0.00 176.35 176.02 2k39 s ILE 44 N 0.45 3.35 0.04 -0.59 1.01 0.32 -1.33 121.20 124.46 2k39 s ILE 44 Ca -0.02 -0.54 -0.06 0.00 0.00 0.00 0.00 60.65 60.02 2k39 s ILE 44 Cb -0.14 -2.45 -0.30 0.00 0.01 0.00 0.00 42.46 39.59 2k39 s ILE 44 CO 0.02 0.50 1.02 2.19 0.00 0.00 0.00 174.94 178.67 2k39 h PHE 45 N 6.89 0.59 0.00 3.97 -0.00 -1.79 0.38 116.94 126.97 2k39 h PHE 45 Ca -0.30 -0.43 0.00 0.00 -0.00 0.00 0.00 57.97 57.25 2k39 h PHE 45 Cb 1.20 -0.02 0.00 0.00 -0.00 0.00 0.00 35.95 37.13 2k39 h PHE 45 CO 0.52 1.38 0.00 0.00 -0.00 0.00 0.00 178.31 180.21 2k39 n ALA 46 N -2.62 2.54 0.00 12.09 0.00 -1.26 -4.34 120.51 126.92 2k39 n ALA 46 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2k39 n ALA 46 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.50 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 1.04 0.00 3.85 0.00 0.00 -1.26 -4.98 105.19 103.84 2k39 n GLY 47 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.43 3.83 0.31 1.61 1.02 -1.26 -5.04 119.74 118.78 2k39 s LYS 48 Ca 0.00 0.30 -0.29 0.00 0.02 0.00 0.00 55.97 56.00 2k39 s LYS 48 Cb 0.00 -3.16 -0.10 0.00 -0.52 0.00 0.00 37.83 34.05 2k39 s LYS 48 CO 0.00 0.67 1.20 -1.14 -0.92 0.00 0.00 175.35 175.16 2k39 s GLN 49 N -1.27 4.47 -0.60 1.68 0.74 -1.26 -3.14 119.66 120.28 2k39 s GLN 49 Ca 0.25 2.00 -0.20 0.00 0.05 0.00 0.00 55.36 57.46 2k39 s GLN 49 Cb -0.16 -3.10 0.09 0.00 1.10 0.00 0.00 33.01 30.95 2k39 s GLN 49 CO 0.13 -0.01 0.76 -0.51 -0.55 0.00 0.00 175.29 175.12 2k39 s LEU 50 N -1.68 5.13 0.04 3.68 1.43 -0.44 -4.94 118.68 121.91 2k39 s LEU 50 Ca 0.47 -1.30 -0.13 0.00 -1.03 0.00 0.00 54.13 52.14 2k39 s LEU 50 Cb -0.35 -2.34 -0.06 0.00 0.03 0.00 0.00 46.19 43.47 2k39 s LEU 50 CO 0.46 -1.18 0.42 -0.70 0.23 0.00 0.00 176.35 175.59 2k39 s GLU 51 N 3.00 3.88 0.25 1.70 2.12 -1.26 -4.61 118.70 123.78 2k39 s GLU 51 Ca 0.14 0.35 -0.31 0.00 0.36 0.00 0.00 54.97 55.52 2k39 s GLU 51 Cb -0.22 -3.12 -0.11 0.00 0.26 0.00 0.00 34.13 30.93 2k39 s GLU 51 CO 0.07 0.63 1.64 -0.51 -0.54 0.00 0.00 175.26 176.55 2k39 s ASP 52 N -1.36 6.39 0.00 -1.70 1.11 -1.26 -3.68 116.67 116.17 2k39 s ASP 52 Ca 0.28 2.90 0.00 0.00 0.18 0.00 0.00 52.55 55.91 2k39 s ASP 52 Cb -0.16 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.21 2k39 s ASP 52 CO 0.16 -0.93 0.00 0.61 1.18 0.00 0.00 175.17 176.19 2k39 n GLY 53 N 2.96 1.75 3.67 0.21 0.00 -1.26 -5.05 105.19 107.48 2k39 n GLY 53 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 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 0.00 2.13 0.34 1.61 0.52 -1.24 -5.02 118.95 117.28 2k39 s ARG 54 Ca 0.00 -2.35 0.09 0.00 -0.52 0.00 0.00 55.73 52.95 2k39 s ARG 54 Cb 0.00 -1.10 -0.05 0.00 0.52 0.00 0.00 34.95 34.31 2k39 s ARG 54 CO 0.00 -0.46 0.02 0.95 0.02 0.00 0.00 175.30 175.83 2k39 s THR 55 N -3.02 2.68 -0.57 0.02 -4.23 -1.26 -1.98 115.64 107.29 2k39 s THR 55 Ca 0.10 -1.95 0.24 0.00 -1.18 0.00 0.00 61.69 58.90 2k39 s THR 55 Cb 0.01 -2.81 0.25 0.00 1.34 0.00 0.00 72.50 71.29 2k39 s THR 55 CO 0.07 -0.21 1.72 0.18 -0.54 0.00 0.00 174.62 175.84 2k39 n LEU 56 N -0.96 0.67 0.04 4.79 4.77 -0.96 -2.58 117.00 122.76 2k39 n LEU 56 Ca -0.04 0.64 -0.10 0.00 -0.03 0.00 0.00 56.01 56.48 2k39 n LEU 56 Cb 0.62 -0.51 0.04 0.00 -2.33 0.00 0.00 43.42 41.24 2k39 n LEU 56 CO 0.43 -0.45 0.40 -1.28 -1.33 0.00 0.00 177.39 175.16 2k39 h SER 57 N 0.00 0.52 -0.96 -1.43 0.87 -1.26 -2.00 113.55 109.30 2k39 h SER 57 Ca 0.00 -0.32 0.21 0.00 -1.23 0.00 0.00 61.79 60.45 2k39 h SER 57 Cb 0.45 -0.15 -0.08 0.00 -0.44 0.00 0.00 62.40 62.17 2k39 h SER 57 CO 0.00 1.04 0.62 0.44 -0.53 0.00 0.00 176.83 178.40 2k39 h ASP 58 N 0.32 0.55 -0.23 6.23 3.32 -1.78 -0.04 116.42 124.80 2k39 h ASP 58 Ca -0.02 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2k39 h ASP 58 Cb 1.22 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2k39 h ASP 58 CO 0.12 0.20 0.00 -1.22 -1.72 0.00 0.00 179.24 176.62 2k39 n TYR 59 N -4.61 0.28 -3.77 4.55 4.02 -1.07 -5.01 117.16 111.55 2k39 n TYR 59 Ca 0.21 -0.18 -0.27 0.00 -0.01 0.00 0.00 57.90 57.66 2k39 n TYR 59 Cb 0.68 -0.00 0.01 0.00 -0.02 0.00 0.00 39.34 40.00 2k39 n TYR 59 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 2k39 n ASN 60 N 1.15 -3.04 -4.74 7.72 2.04 -0.03 -4.95 115.26 113.41 2k39 n ASN 60 Ca 0.14 -0.83 -0.41 0.00 -0.44 0.00 0.00 54.58 53.04 2k39 n ASN 60 Cb 0.51 -1.10 -0.04 0.00 -2.53 0.00 0.00 39.78 36.61 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -0.44 0.00 0.00 177.26 176.19 2k39 s ILE 61 N -3.48 4.11 0.45 1.53 -1.09 -1.12 -5.03 121.20 116.57 2k39 s ILE 61 Ca 0.21 1.83 0.08 0.00 -2.23 0.00 0.00 60.65 60.55 2k39 s ILE 61 Cb -0.12 -4.17 0.02 0.00 -1.58 0.00 0.00 42.46 36.62 2k39 s ILE 61 CO 0.66 0.32 0.61 -1.10 -1.23 0.00 0.00 174.94 174.19 2k39 s GLN 62 N -0.34 2.72 0.48 2.79 -1.52 -1.26 -4.95 119.66 117.58 2k39 s GLN 62 Ca 0.47 -1.33 -0.23 0.00 -1.95 0.00 0.00 55.36 52.33 2k39 s GLN 62 Cb -0.27 -2.72 -0.07 0.00 -0.22 0.00 0.00 33.01 29.73 2k39 s GLN 62 CO 0.33 -0.38 1.23 -1.59 -0.25 0.00 0.00 175.29 174.63 2k39 s LYS 63 N -4.40 3.59 -1.18 2.91 -2.85 -1.26 -3.04 119.74 113.50 2k39 s LYS 63 Ca 0.56 1.94 0.00 0.00 -1.00 0.00 0.00 55.97 57.47 2k39 s LYS 63 Cb -0.09 -2.39 0.00 0.00 -2.06 0.00 0.00 37.83 33.29 2k39 s LYS 63 CO 0.34 -0.73 0.00 0.39 0.10 0.00 0.00 175.35 175.44 2k39 n GLU 64 N -0.59 -1.14 -1.90 1.78 1.02 0.48 -4.98 120.64 115.31 2k39 n GLU 64 Ca 0.08 0.86 -0.37 0.00 -0.02 0.00 0.00 57.16 57.70 2k39 n GLU 64 Cb 0.47 -4.97 0.04 0.00 -0.02 0.00 0.00 31.44 26.95 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 -2.63 5.22 -0.45 1.62 0.01 -1.17 -4.78 113.70 111.52 2k39 s SER 65 Ca 0.00 2.57 -0.15 0.00 1.31 0.00 0.00 55.95 59.68 2k39 s SER 65 Cb 0.00 -2.62 0.06 0.00 0.21 0.00 0.00 66.02 63.67 2k39 s SER 65 CO 0.00 -1.59 0.36 -0.89 0.41 0.00 0.00 173.24 171.53 2k39 s THR 66 N -1.43 5.23 0.29 1.44 2.01 -1.26 -1.22 115.64 120.70 2k39 s THR 66 Ca 0.75 -0.94 0.03 0.00 0.31 0.00 0.00 61.69 61.83 2k39 s THR 66 Cb -0.36 -4.06 -0.03 0.00 0.01 0.00 0.00 72.50 68.07 2k39 s THR 66 CO 0.40 -0.49 0.45 -0.76 -0.69 0.00 0.00 174.62 173.53 2k39 s LEU 67 N 1.65 4.17 0.19 4.42 1.43 0.03 -4.65 118.68 125.92 2k39 s LEU 67 Ca 0.04 0.26 0.10 0.00 -1.03 0.00 0.00 54.13 53.50 2k39 s LEU 67 Cb -0.23 -3.09 -0.04 0.00 0.03 0.00 0.00 46.19 42.86 2k39 s LEU 67 CO 0.08 -0.18 -0.14 -1.38 0.23 0.00 0.00 176.35 174.95 2k39 s HIS 68 N -2.14 2.51 0.14 0.29 -3.43 0.13 -0.39 115.29 112.40 2k39 s HIS 68 Ca 0.37 -0.27 0.07 0.00 -0.80 0.00 0.00 55.06 54.43 2k39 s HIS 68 Cb -0.09 -1.22 -0.04 0.00 -1.43 0.00 0.00 32.58 29.80 2k39 s HIS 68 CO 0.32 0.52 -0.15 -0.48 -2.00 0.00 0.00 174.74 172.96 2k39 s LEU 69 N -2.85 2.43 -0.05 5.38 0.05 -0.87 -0.52 118.68 122.24 2k39 s LEU 69 Ca 0.24 -0.84 -0.20 0.00 0.05 0.00 0.00 54.13 53.38 2k39 s LEU 69 Cb -0.08 -0.64 0.04 0.00 -2.05 0.00 0.00 46.19 43.46 2k39 s LEU 69 CO 0.14 -0.12 0.45 0.54 -0.55 0.00 0.00 176.35 176.80 2k39 s VAL 70 N -2.20 0.03 0.13 1.48 0.11 -0.62 -4.44 120.40 114.89 2k39 s VAL 70 Ca 0.12 -0.25 -0.34 0.00 -2.93 0.00 0.00 61.98 58.57 2k39 s VAL 70 Cb -0.05 -0.73 -0.14 0.00 -1.53 0.00 0.00 36.38 33.93 2k39 s VAL 70 CO 0.04 -0.14 1.56 0.18 -3.33 0.00 0.00 175.10 173.41 2k39 n LEU 71 N 1.45 2.88 -2.87 2.54 4.77 -1.26 -0.99 117.00 123.52 2k39 n LEU 71 Ca -0.19 1.08 -0.35 0.00 -0.03 0.00 0.00 56.01 56.52 2k39 n LEU 71 Cb 0.56 -1.38 0.02 0.00 -2.33 0.00 0.00 43.42 40.29 2k39 n LEU 71 CO 0.21 -0.40 0.96 -1.14 -1.33 0.00 0.00 177.39 175.69 2k39 n ARG 72 N 3.49 3.37 -3.37 3.23 0.00 0.18 -4.85 116.66 118.70 2k39 n ARG 72 Ca 0.18 -4.12 -0.19 0.00 -0.00 0.00 0.00 57.85 53.72 2k39 n ARG 72 Cb 0.27 -2.29 -0.02 0.00 0.00 0.00 0.00 32.46 30.42 2k39 n ARG 72 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.63 179.10 2k39 n LEU 73 N -0.43 0.00 0.00 6.15 -0.00 -1.26 -4.68 117.00 116.77 2k39 n LEU 73 Ca 0.46 -1.93 0.00 0.00 -0.00 0.00 0.00 56.01 54.54 2k39 n LEU 73 Cb 0.39 0.11 0.00 0.00 -0.00 0.00 0.00 43.42 43.92 2k39 n LEU 73 CO 0.44 -0.37 0.00 -1.14 -0.00 0.00 0.00 177.39 176.32 2k39 n ARG 74 N -1.04 1.53 -4.26 1.47 0.63 -1.26 -5.12 116.66 108.61 2k39 n ARG 74 Ca -0.08 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.71 2k39 n ARG 74 Cb 0.40 -0.34 -0.10 0.00 0.45 0.00 0.00 32.46 32.87 2k39 n ARG 74 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2k39 s GLY 75 N -0.62 1.36 0.00 5.14 0.00 -1.26 -5.31 107.32 106.63 2k39 s GLY 75 Ca 0.00 -1.67 0.05 0.00 0.00 0.00 0.00 44.72 43.10 2k39 s GLY 75 CO 0.00 -1.55 0.66 0.61 0.00 0.00 0.00 173.10 172.82