#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 1.60 0.38 2.12 -0.21 -1.26 -0.72 119.66 121.57 2k39 s GLN 2 Ca 0.00 -0.69 0.05 0.00 0.02 0.00 0.00 55.36 54.74 2k39 s GLN 2 Cb 0.00 -1.53 -0.02 0.00 1.00 0.00 0.00 33.01 32.46 2k39 s GLN 2 CO 0.00 0.40 0.19 0.44 -2.12 0.00 0.00 175.29 174.20 2k39 n ILE 3 N 2.65 0.00 -4.23 1.08 -5.35 -0.46 0.19 119.36 113.24 2k39 n ILE 3 Ca -0.15 -2.37 -0.13 0.00 -0.27 0.00 0.00 62.75 59.83 2k39 n ILE 3 Cb 0.53 0.96 -0.10 0.00 -1.74 0.00 0.00 39.64 39.29 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 -3.15 1.16 -0.00 4.28 0.08 0.76 -1.64 117.98 119.47 2k39 s PHE 4 Ca 0.26 -0.84 0.04 0.00 0.12 0.00 0.00 56.93 56.52 2k39 s PHE 4 Cb 0.01 -0.62 -0.01 0.00 -0.57 0.00 0.00 43.02 41.83 2k39 s PHE 4 CO 0.19 -0.02 -0.14 0.08 -0.10 0.00 0.00 175.22 175.23 2k39 s VAL 5 N -3.45 1.09 -0.18 -0.44 1.01 0.21 -1.24 120.40 117.41 2k39 s VAL 5 Ca 0.16 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 2k39 s VAL 5 Cb 0.04 -0.92 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 2k39 s VAL 5 CO -0.00 0.25 -0.02 -0.75 0.00 0.00 0.00 175.10 174.57 2k39 s LYS 6 N -0.47 3.62 0.88 2.72 2.20 0.03 -0.34 119.74 128.37 2k39 s LYS 6 Ca 0.05 -0.53 -0.14 0.00 -0.36 0.00 0.00 55.97 54.99 2k39 s LYS 6 Cb -0.06 -2.98 0.13 0.00 -1.51 0.00 0.00 37.83 33.41 2k39 s LYS 6 CO -0.00 0.12 1.23 0.95 -0.36 0.00 0.00 175.35 177.29 2k39 s THR 7 N 0.70 2.00 0.13 3.43 -4.23 -0.88 -0.72 115.64 116.07 2k39 s THR 7 Ca -0.01 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.54 2k39 s THR 7 Cb -0.14 -2.99 -0.20 0.00 1.34 0.00 0.00 72.50 70.51 2k39 s THR 7 CO 0.02 0.00 1.30 -0.07 -0.54 0.00 0.00 174.62 175.33 2k39 h LEU 8 N -1.31 0.13 -2.31 4.79 3.38 -1.90 -2.64 115.31 115.45 2k39 h LEU 8 Ca -0.46 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.39 2k39 h LEU 8 Cb 1.29 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 2k39 h LEU 8 CO 0.55 1.04 -0.02 0.00 0.09 0.00 0.00 178.44 180.10 2k39 h THR 9 N 0.03 0.13 0.00 0.22 1.03 -1.95 -3.46 112.91 108.90 2k39 h THR 9 Ca -0.04 -0.25 0.00 0.00 -0.01 0.00 0.00 66.41 66.11 2k39 h THR 9 Cb 1.71 1.22 0.00 0.00 -1.07 0.00 0.00 68.15 70.01 2k39 h THR 9 CO 0.14 0.02 0.00 0.61 -0.01 0.00 0.00 175.52 176.28 2k39 n GLY 10 N -0.68 0.95 3.65 2.99 0.00 -0.99 -5.07 105.19 106.03 2k39 n GLY 10 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.77 4.09 -0.66 1.61 2.20 -1.26 -4.83 119.74 120.12 2k39 s LYS 11 Ca 0.00 2.20 -0.13 0.00 -0.36 0.00 0.00 55.97 57.69 2k39 s LYS 11 Cb 0.00 -4.04 0.17 0.00 -1.51 0.00 0.00 37.83 32.45 2k39 s LYS 11 CO 0.00 -0.96 0.58 0.99 -0.36 0.00 0.00 175.35 175.60 2k39 s THR 12 N 4.40 5.05 0.51 3.43 2.01 -1.26 -2.07 115.64 127.73 2k39 s THR 12 Ca 0.77 -2.11 -0.23 0.00 0.31 0.00 0.00 61.69 60.43 2k39 s THR 12 Cb -0.34 -4.20 -0.06 0.00 0.01 0.00 0.00 72.50 67.91 2k39 s THR 12 CO 0.32 -0.92 1.39 -0.38 -0.69 0.00 0.00 174.62 174.34 2k39 n ILE 13 N 4.47 3.48 -4.08 1.82 2.08 0.54 -4.87 119.36 122.79 2k39 n ILE 13 Ca 0.01 -0.50 -0.35 0.00 0.56 0.00 0.00 62.75 62.47 2k39 n ILE 13 Cb 0.43 -1.74 -0.07 0.00 -0.75 0.00 0.00 39.64 37.51 2k39 n ILE 13 CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 2k39 s THR 14 N -1.25 4.94 -0.06 1.39 2.01 -1.26 -0.62 115.64 120.78 2k39 s THR 14 Ca 0.68 -0.15 0.04 0.00 0.31 0.00 0.00 61.69 62.57 2k39 s THR 14 Cb -0.43 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 68.90 2k39 s THR 14 CO 0.52 0.50 -0.18 -0.76 -0.69 0.00 0.00 174.62 174.01 2k39 s LEU 15 N -1.32 1.88 0.02 4.42 1.43 -0.65 -4.89 118.68 119.57 2k39 s LEU 15 Ca 0.18 -0.39 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 2k39 s LEU 15 Cb -0.12 -1.05 -0.05 0.00 0.03 0.00 0.00 46.19 45.00 2k39 s LEU 15 CO 0.08 0.12 1.19 -0.70 0.23 0.00 0.00 176.35 177.28 2k39 s GLU 16 N 0.28 4.41 0.05 1.70 2.56 -1.26 -1.36 118.70 125.08 2k39 s GLU 16 Ca -0.10 1.72 -0.02 0.00 0.00 0.00 0.00 54.97 56.57 2k39 s GLU 16 Cb -0.14 -3.43 -0.03 0.00 2.00 0.00 0.00 34.13 32.53 2k39 s GLU 16 CO 0.04 -0.31 -0.01 0.14 -0.56 0.00 0.00 175.26 174.56 2k39 s VAL 17 N 1.45 0.19 0.08 3.70 -7.23 0.10 -4.98 120.40 113.71 2k39 s VAL 17 Ca 0.58 -1.57 0.03 0.00 -1.81 0.00 0.00 61.98 59.21 2k39 s VAL 17 Cb -0.27 -1.26 -0.04 0.00 0.56 0.00 0.00 36.38 35.37 2k39 s VAL 17 CO 0.27 -0.87 0.05 -0.70 -0.31 0.00 0.00 175.10 173.53 2k39 s GLU 18 N -3.42 2.76 0.28 4.82 2.56 -1.26 -0.82 118.70 123.62 2k39 s GLU 18 Ca 0.02 -0.73 0.25 0.00 0.00 0.00 0.00 54.97 54.51 2k39 s GLU 18 Cb 0.04 -2.66 1.01 0.00 2.00 0.00 0.00 34.13 34.52 2k39 s GLU 18 CO -0.08 0.56 1.74 -1.00 -0.56 0.00 0.00 175.26 175.92 2k39 h PRO 19 N 3.43 0.00 -0.11 4.30 0.13 -1.98 -2.85 132.00 134.92 2k39 h PRO 19 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2k39 h PRO 19 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2k39 h PRO 19 CO 0.63 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.27 2k39 n SER 20 N -2.32 2.90 -4.82 1.44 3.41 -1.26 -2.03 113.62 110.93 2k39 n SER 20 Ca 0.02 -1.94 -0.33 0.00 -0.26 0.00 0.00 58.87 56.37 2k39 n SER 20 Cb 0.25 -0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.11 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 -1.87 6.36 0.41 4.04 1.01 -1.08 -4.76 116.67 120.77 2k39 s ASP 21 Ca 0.32 1.70 -0.05 0.00 0.71 0.00 0.00 52.55 55.22 2k39 s ASP 21 Cb 0.21 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.57 2k39 s ASP 21 CO 0.31 -0.77 0.69 0.42 0.21 0.00 0.00 175.17 176.03 2k39 s THR 22 N -2.46 4.95 0.27 -1.27 -4.23 -1.26 -1.21 115.64 110.43 2k39 s THR 22 Ca 0.62 0.11 0.11 0.00 -1.18 0.00 0.00 61.69 61.35 2k39 s THR 22 Cb -0.12 -3.82 -0.01 0.00 1.34 0.00 0.00 72.50 69.89 2k39 s THR 22 CO 0.30 -0.64 1.63 0.40 -0.54 0.00 0.00 174.62 175.77 2k39 h ILE 23 N 0.68 1.40 -0.82 2.99 1.08 -1.94 -1.51 117.51 119.39 2k39 h ILE 23 Ca -0.48 -2.04 0.02 0.00 -0.39 0.00 0.00 64.86 61.97 2k39 h ILE 23 Cb 1.20 2.11 -0.04 0.00 -3.07 0.00 0.00 36.82 37.02 2k39 h ILE 23 CO 0.63 0.58 0.54 -0.08 -0.69 0.00 0.00 178.15 179.13 2k39 h GLU 24 N 0.00 1.05 0.00 2.37 4.22 -1.95 -0.75 114.58 119.52 2k39 h GLU 24 Ca -0.01 -0.06 -0.03 0.00 0.08 0.00 0.00 59.36 59.34 2k39 h GLU 24 Cb 1.06 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 30.07 2k39 h GLU 24 CO 0.08 0.69 -0.13 -0.97 -2.18 0.00 0.00 179.01 176.51 2k39 h ASN 25 N 1.08 0.00 0.44 1.04 -1.24 -1.70 -2.43 115.58 112.77 2k39 h ASN 25 Ca 0.31 0.00 -0.29 0.00 0.71 0.00 0.00 56.30 57.03 2k39 h ASN 25 Cb -0.08 0.00 0.02 0.00 0.73 0.00 0.00 38.32 38.99 2k39 h ASN 25 CO -0.07 0.13 -1.28 0.58 -1.29 0.00 0.00 177.43 175.49 2k39 h VAL 26 N 0.00 1.40 -0.00 2.57 2.07 -0.69 -3.26 116.25 118.33 2k39 h VAL 26 Ca -0.00 -2.83 -0.05 0.00 0.82 0.00 0.00 66.70 64.64 2k39 h VAL 26 Cb 0.92 2.89 -0.01 0.00 -1.52 0.00 0.00 31.29 33.57 2k39 h VAL 26 CO 0.02 0.84 -0.23 0.11 0.02 0.00 0.00 177.57 178.32 2k39 h LYS 27 N 0.14 0.01 -0.00 1.57 1.57 -1.19 -2.38 116.57 116.28 2k39 h LYS 27 Ca -0.17 -0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.45 2k39 h LYS 27 Cb 1.98 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.27 2k39 h LYS 27 CO 0.22 0.24 -0.77 0.00 -0.57 0.00 0.00 179.45 178.57 2k39 h ALA 28 N 1.76 0.73 0.00 3.86 0.00 -1.51 0.88 119.26 124.99 2k39 h ALA 28 Ca -0.00 -0.69 -0.11 0.00 0.00 0.00 0.00 54.91 54.10 2k39 h ALA 28 Cb 0.41 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2k39 h ALA 28 CO 0.03 0.95 -0.53 0.87 0.00 0.00 0.00 179.25 180.57 2k39 h LYS 29 N 0.01 0.00 0.08 0.00 1.57 -1.55 -2.57 116.57 114.12 2k39 h LYS 29 Ca -0.01 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.50 2k39 h LYS 29 Cb 1.36 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.65 2k39 h LYS 29 CO 0.10 0.53 -1.32 0.82 -0.57 0.00 0.00 179.45 179.01 2k39 h ILE 30 N 0.00 1.38 -0.80 1.86 1.08 -1.21 0.10 117.51 119.92 2k39 h ILE 30 Ca -0.01 -3.03 0.11 0.00 -0.39 0.00 0.00 64.86 61.55 2k39 h ILE 30 Cb 1.38 2.82 -0.06 0.00 -3.07 0.00 0.00 36.82 37.89 2k39 h ILE 30 CO 0.07 0.85 0.52 -0.61 -0.69 0.00 0.00 178.15 178.30 2k39 h GLN 31 N 0.05 0.65 0.45 2.37 -0.00 -0.80 0.19 115.11 118.02 2k39 h GLN 31 Ca -0.15 -0.04 -0.02 0.00 -0.00 0.00 0.00 58.65 58.43 2k39 h GLN 31 Cb 1.94 -0.15 0.00 0.00 0.00 0.00 0.00 27.48 29.28 2k39 h GLN 31 CO 0.16 0.43 -0.22 0.22 0.00 0.00 0.00 178.83 179.43 2k39 h ASP 32 N 0.67 -0.51 0.08 -0.69 3.58 -1.37 -3.08 116.42 115.09 2k39 h ASP 32 Ca 0.38 0.01 0.01 0.00 0.42 0.00 0.00 57.03 57.85 2k39 h ASP 32 Cb 0.56 0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.72 2k39 h ASP 32 CO -0.15 -0.09 -0.27 0.11 -2.88 0.00 0.00 179.24 175.97 2k39 h LYS 33 N -1.16 -0.38 0.00 0.28 1.79 -0.70 -3.38 116.57 113.03 2k39 h LYS 33 Ca -0.06 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 2k39 h LYS 33 Cb 0.47 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 2k39 h LYS 33 CO 0.10 -0.25 0.00 0.39 -1.08 0.00 0.00 179.45 178.61 2k39 n GLU 34 N -3.98 6.74 -0.14 3.15 -0.58 0.65 -5.03 120.64 121.44 2k39 n GLU 34 Ca -0.04 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 2k39 n GLU 34 Cb 0.21 -0.49 0.00 0.00 -0.57 0.00 0.00 31.44 30.59 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 0.96 0.58 3.75 0.62 0.00 -1.02 -4.99 105.19 105.09 2k39 n GLY 35 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.32 5.25 -0.19 -0.61 -1.09 -1.26 -4.91 121.20 116.08 2k39 s ILE 36 Ca 0.00 0.65 -0.40 0.00 -2.23 0.00 0.00 60.65 58.68 2k39 s ILE 36 Cb 0.00 -3.67 -0.16 0.00 -1.58 0.00 0.00 42.46 37.05 2k39 s ILE 36 CO 0.00 0.42 1.62 -2.65 -1.23 0.00 0.00 174.94 173.09 2k39 n PRO 37 N 3.24 1.07 -0.27 2.79 -0.02 -1.26 -4.01 135.00 136.54 2k39 n PRO 37 Ca -0.12 0.39 0.10 0.00 -2.02 0.00 0.00 63.50 61.85 2k39 n PRO 37 Cb 0.52 -2.05 0.20 0.00 -0.02 0.00 0.00 33.50 32.15 2k39 n PRO 37 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2k39 n PRO 38 N 4.47 -0.06 0.19 0.52 -0.02 -1.26 -1.79 135.00 137.04 2k39 n PRO 38 Ca 0.24 1.16 0.14 0.00 -2.02 0.00 0.00 63.50 63.02 2k39 n PRO 38 Cb 0.13 -1.82 0.61 0.00 -0.02 0.00 0.00 33.50 32.41 2k39 n PRO 38 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2k39 h ASP 39 N 0.00 0.00 0.21 2.55 3.32 -1.97 -2.04 116.42 118.48 2k39 h ASP 39 Ca 0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.49 2k39 h ASP 39 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.41 2k39 h ASP 39 CO -0.74 0.00 -0.52 0.00 -1.72 0.00 0.00 179.24 176.26 2k39 n GLN 40 N -2.50 0.51 -3.06 3.56 6.02 -0.74 -4.88 117.38 116.29 2k39 n GLN 40 Ca 0.01 -0.36 -0.40 0.00 -0.01 0.00 0.00 57.00 56.24 2k39 n GLN 40 Cb 0.20 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 29.92 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 -2.74 4.43 -0.02 -1.09 -0.21 -0.77 -1.10 119.66 118.16 2k39 s GLN 41 Ca 0.16 0.85 0.06 0.00 0.02 0.00 0.00 55.36 56.46 2k39 s GLN 41 Cb 0.18 -3.44 -0.02 0.00 1.00 0.00 0.00 33.01 30.72 2k39 s GLN 41 CO 0.65 0.08 -0.20 0.50 -2.12 0.00 0.00 175.29 174.21 2k39 s ARG 42 N 0.75 2.26 -0.25 2.91 3.52 0.23 -4.88 118.95 123.48 2k39 s ARG 42 Ca 0.37 -0.85 0.02 0.00 -0.13 0.00 0.00 55.73 55.14 2k39 s ARG 42 Cb -0.18 -2.21 0.05 0.00 -1.56 0.00 0.00 34.95 31.06 2k39 s ARG 42 CO 0.18 0.58 -0.11 -0.51 -0.81 0.00 0.00 175.30 174.63 2k39 s LEU 43 N -0.83 3.34 -0.27 -0.88 1.43 -1.26 -1.58 118.68 118.63 2k39 s LEU 43 Ca 0.11 -1.30 -0.08 0.00 -1.03 0.00 0.00 54.13 51.84 2k39 s LEU 43 Cb -0.10 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.53 2k39 s LEU 43 CO 0.01 -0.17 0.10 -0.63 0.23 0.00 0.00 176.35 175.89 2k39 s ILE 44 N 1.14 4.48 -0.07 -0.59 1.01 -1.22 -1.70 121.20 124.24 2k39 s ILE 44 Ca -0.07 -0.23 0.03 0.00 0.00 0.00 0.00 60.65 60.38 2k39 s ILE 44 Cb -0.19 -3.16 0.01 0.00 0.01 0.00 0.00 42.46 39.13 2k39 s ILE 44 CO -0.06 0.25 -0.15 0.12 0.00 0.00 0.00 174.94 175.10 2k39 s PHE 45 N 1.62 1.70 -1.97 3.97 5.36 -0.38 -3.45 117.98 124.84 2k39 s PHE 45 Ca 0.06 -0.63 0.00 0.00 -0.96 0.00 0.00 56.93 55.40 2k39 s PHE 45 Cb -0.16 -1.20 0.00 0.00 -0.34 0.00 0.00 43.02 41.32 2k39 s PHE 45 CO 0.05 -0.29 0.00 0.00 -1.46 0.00 0.00 175.22 173.52 2k39 n ALA 46 N 3.66 -0.28 0.00 11.12 0.00 -1.26 -0.65 120.51 133.09 2k39 n ALA 46 Ca -0.21 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2k39 n ALA 46 Cb 0.52 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 18.04 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 -0.51 2.71 3.87 0.00 0.00 -1.26 -5.09 105.19 104.91 2k39 n GLY 47 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.81 3.78 -0.39 1.61 -0.14 0.17 -5.06 119.74 118.91 2k39 s LYS 48 Ca 0.00 0.21 -0.18 0.00 -1.36 0.00 0.00 55.97 54.64 2k39 s LYS 48 Cb 0.00 -2.91 0.01 0.00 -1.68 0.00 0.00 37.83 33.25 2k39 s LYS 48 CO 0.00 0.50 0.50 -1.14 -0.76 0.00 0.00 175.35 174.45 2k39 s GLN 49 N -2.15 3.39 -0.45 1.68 2.00 -1.26 -1.25 119.66 121.61 2k39 s GLN 49 Ca 0.37 -0.41 -0.29 0.00 -2.00 0.00 0.00 55.36 53.03 2k39 s GLN 49 Cb -0.13 -3.89 0.03 0.00 0.80 0.00 0.00 33.01 29.82 2k39 s GLN 49 CO 0.20 -0.77 1.12 -0.51 -0.50 0.00 0.00 175.29 174.82 2k39 s LEU 50 N 2.37 3.70 0.18 3.68 1.02 -0.69 -4.91 118.68 124.03 2k39 s LEU 50 Ca 0.17 0.56 0.25 0.00 0.02 0.00 0.00 54.13 55.13 2k39 s LEU 50 Cb -0.16 -3.53 0.58 0.00 0.02 0.00 0.00 46.19 43.10 2k39 s LEU 50 CO 0.14 -1.18 1.56 -0.33 0.02 0.00 0.00 176.35 176.56 2k39 h GLU 51 N 9.02 0.00 0.00 1.70 4.39 -1.96 -3.42 114.58 124.32 2k39 h GLU 51 Ca -0.23 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2k39 h GLU 51 Cb 1.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 2k39 h GLU 51 CO 1.11 0.00 0.00 -3.47 -1.16 0.00 0.00 179.01 175.49 2k39 n ASP 52 N -2.23 0.00 0.00 1.42 -0.08 -1.26 -5.07 116.55 109.33 2k39 n ASP 52 Ca 0.04 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.32 2k39 n ASP 52 Cb 0.44 0.20 0.00 0.00 2.34 0.00 0.00 41.12 44.10 2k39 n ASP 52 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2k39 n GLY 53 N 0.83 1.90 3.33 0.27 0.00 -1.26 -5.09 105.19 105.17 2k39 n GLY 53 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.86 1.08 0.57 1.61 0.52 -1.26 -5.14 118.95 115.48 2k39 s ARG 54 Ca 0.00 -0.74 0.07 0.00 -0.52 0.00 0.00 55.73 54.54 2k39 s ARG 54 Cb 0.00 0.47 0.08 0.00 0.52 0.00 0.00 34.95 36.02 2k39 s ARG 54 CO 0.00 -0.42 0.79 0.95 0.02 0.00 0.00 175.30 176.63 2k39 s THR 55 N -3.82 2.31 0.29 0.02 -4.23 -1.26 -4.23 115.64 104.72 2k39 s THR 55 Ca 0.04 -0.92 -0.01 0.00 -1.18 0.00 0.00 61.69 59.62 2k39 s THR 55 Cb 0.02 -2.39 0.19 0.00 1.34 0.00 0.00 72.50 71.66 2k39 s THR 55 CO -0.11 0.00 1.88 0.25 -0.54 0.00 0.00 174.62 176.10 2k39 h LEU 56 N 0.13 0.80 -1.26 4.79 5.85 -1.36 -0.01 115.31 124.25 2k39 h LEU 56 Ca -0.33 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.23 2k39 h LEU 56 Cb 1.28 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 2k39 h LEU 56 CO 0.42 0.71 -0.07 0.77 -0.34 0.00 0.00 178.44 179.93 2k39 h SER 57 N 0.87 0.39 0.27 1.25 4.64 -1.68 -3.18 113.55 116.11 2k39 h SER 57 Ca 0.21 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.43 2k39 h SER 57 Cb 0.16 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2k39 h SER 57 CO -0.02 0.51 -0.13 0.44 -0.87 0.00 0.00 176.83 176.76 2k39 h ASP 58 N 0.40 -0.31 0.00 4.97 3.32 -1.42 -3.32 116.42 120.06 2k39 h ASP 58 Ca 0.08 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.93 2k39 h ASP 58 Cb 0.38 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.01 2k39 h ASP 58 CO 0.02 0.18 0.00 -1.22 -1.72 0.00 0.00 179.24 176.50 2k39 n TYR 59 N -5.03 0.00 -1.04 4.55 4.01 -0.18 -4.92 117.16 114.55 2k39 n TYR 59 Ca -0.08 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.65 2k39 n TYR 59 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.27 2k39 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2k39 n ASN 60 N -0.95 -3.21 -4.44 7.72 2.85 -1.21 -5.00 115.26 111.03 2k39 n ASN 60 Ca 0.05 0.03 -0.44 0.00 -0.11 0.00 0.00 54.58 54.12 2k39 n ASN 60 Cb 0.02 -0.83 -0.06 0.00 1.24 0.00 0.00 39.78 40.15 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2k39 s ILE 61 N -2.04 4.85 0.05 -1.44 1.01 -1.22 -5.04 121.20 117.38 2k39 s ILE 61 Ca 0.00 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.15 2k39 s ILE 61 Cb 0.00 -4.32 0.01 0.00 0.01 0.00 0.00 42.46 38.16 2k39 s ILE 61 CO 0.00 -0.84 0.07 0.00 0.00 0.00 0.00 174.94 174.16 2k39 n GLN 62 N 6.23 0.96 -1.91 2.79 1.13 -1.26 -4.75 117.38 120.56 2k39 n GLN 62 Ca -0.06 -0.25 -0.42 0.00 -1.94 0.00 0.00 57.00 54.32 2k39 n GLN 62 Cb 0.45 -0.02 -0.03 0.00 0.11 0.00 0.00 30.24 30.75 2k39 n GLN 62 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2k39 s LYS 63 N -2.22 4.17 -0.24 -1.09 1.02 -1.26 -2.63 119.74 117.49 2k39 s LYS 63 Ca 0.05 2.31 0.00 0.00 0.02 0.00 0.00 55.97 58.35 2k39 s LYS 63 Cb -0.00 -4.02 0.00 0.00 -0.52 0.00 0.00 37.83 33.29 2k39 s LYS 63 CO 0.03 -0.87 0.00 0.39 -0.92 0.00 0.00 175.35 173.98 2k39 n GLU 64 N 7.17 -0.19 -2.34 1.68 4.71 0.13 -5.02 120.64 126.79 2k39 n GLU 64 Ca 0.18 0.37 -0.36 0.00 -0.01 0.00 0.00 57.16 57.34 2k39 n GLU 64 Cb 0.42 -3.99 -0.01 0.00 -1.01 0.00 0.00 31.44 26.85 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2k39 s SER 65 N -2.93 6.13 -0.13 1.62 0.01 -1.08 -4.74 113.70 112.58 2k39 s SER 65 Ca 0.00 2.17 0.00 0.00 1.31 0.00 0.00 55.95 59.43 2k39 s SER 65 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.63 2k39 s SER 65 CO 0.00 -0.94 -0.14 -0.89 0.41 0.00 0.00 173.24 171.68 2k39 s THR 66 N -1.70 2.92 0.22 1.44 2.01 -1.26 -0.17 115.64 119.11 2k39 s THR 66 Ca 0.66 -0.70 -0.07 0.00 0.31 0.00 0.00 61.69 61.89 2k39 s THR 66 Cb -0.24 -2.22 -0.06 0.00 0.01 0.00 0.00 72.50 69.98 2k39 s THR 66 CO 0.29 0.52 0.50 -0.76 -0.69 0.00 0.00 174.62 174.48 2k39 s LEU 67 N 0.46 4.17 -0.21 4.42 1.43 -0.37 -4.90 118.68 123.68 2k39 s LEU 67 Ca -0.10 0.76 -0.12 0.00 -1.03 0.00 0.00 54.13 53.65 2k39 s LEU 67 Cb -0.16 -3.53 -0.05 0.00 0.03 0.00 0.00 46.19 42.48 2k39 s LEU 67 CO 0.05 -0.07 0.20 -2.28 0.23 0.00 0.00 176.35 174.48 2k39 s HIS 68 N -1.84 3.37 -0.26 0.29 5.65 -1.22 -0.79 115.29 120.49 2k39 s HIS 68 Ca 0.45 0.36 -0.07 0.00 0.25 0.00 0.00 55.06 56.05 2k39 s HIS 68 Cb -0.11 -2.28 -0.01 0.00 -1.18 0.00 0.00 32.58 28.99 2k39 s HIS 68 CO 0.24 0.15 0.06 -1.17 -0.65 0.00 0.00 174.74 173.38 2k39 s LEU 69 N 0.79 3.50 0.28 8.88 2.96 0.10 -3.46 118.68 131.73 2k39 s LEU 69 Ca 0.11 -0.38 0.11 0.00 -0.22 0.00 0.00 54.13 53.75 2k39 s LEU 69 Cb -0.13 -1.89 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 2k39 s LEU 69 CO 0.03 -0.08 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.11 2k39 s VAL 70 N 1.57 2.38 0.26 1.68 1.01 -0.61 -3.76 120.40 122.93 2k39 s VAL 70 Ca 0.05 -2.36 -0.05 0.00 0.00 0.00 0.00 61.98 59.61 2k39 s VAL 70 Cb -0.16 -2.33 -0.06 0.00 0.00 0.00 0.00 36.38 33.83 2k39 s VAL 70 CO 0.02 -0.38 0.53 -0.76 0.00 0.00 0.00 175.10 174.51 2k39 s LEU 71 N -3.51 4.11 0.15 3.92 1.43 -1.26 -0.60 118.68 122.90 2k39 s LEU 71 Ca 0.30 0.72 -0.12 0.00 -1.03 0.00 0.00 54.13 54.00 2k39 s LEU 71 Cb -0.04 -3.52 -0.07 0.00 0.03 0.00 0.00 46.19 42.60 2k39 s LEU 71 CO 0.15 -0.14 0.51 -0.13 0.23 0.00 0.00 176.35 176.96 2k39 s ARG 72 N -3.33 3.88 0.07 1.70 0.52 -0.26 -4.83 118.95 116.70 2k39 s ARG 72 Ca 0.44 0.35 0.20 0.00 -0.52 0.00 0.00 55.73 56.21 2k39 s ARG 72 Cb -0.11 -2.89 -0.15 0.00 0.52 0.00 0.00 34.95 32.32 2k39 s ARG 72 CO 0.28 0.47 0.75 1.28 0.02 0.00 0.00 175.30 178.09 2k39 n LEU 73 N 0.63 0.55 -3.74 2.53 4.77 -1.26 -4.91 117.00 115.57 2k39 n LEU 73 Ca -0.05 0.22 -0.12 0.00 -0.03 0.00 0.00 56.01 56.03 2k39 n LEU 73 Cb 0.52 0.04 -0.11 0.00 -2.33 0.00 0.00 43.42 41.54 2k39 n LEU 73 CO 0.43 0.01 -0.01 -0.60 -1.33 0.00 0.00 177.39 175.89 2k39 s ARG 74 N -3.22 0.36 0.08 3.23 6.06 -1.26 -5.17 118.95 119.04 2k39 s ARG 74 Ca -0.04 0.56 0.04 0.00 -2.50 0.00 0.00 55.73 53.79 2k39 s ARG 74 Cb 0.10 0.08 -0.04 0.00 0.06 0.00 0.00 34.95 35.15 2k39 s ARG 74 CO 0.83 -0.10 0.04 0.20 -2.50 0.00 0.00 175.30 173.78 2k39 s GLY 75 N 0.68 1.97 0.00 8.12 0.00 -1.26 -5.09 107.32 111.74 2k39 s GLY 75 Ca -0.04 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 43.62 2k39 s GLY 75 CO -0.04 -1.04 0.00 0.61 0.00 0.00 0.00 173.10 172.62