#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 3.40 0.10 3.17 -2.07 -1.26 -1.09 119.66 121.91 2k39 s GLN 2 Ca 0.00 -0.31 0.04 0.00 -1.82 0.00 0.00 55.36 53.27 2k39 s GLN 2 Cb 0.00 -3.02 -0.04 0.00 -1.09 0.00 0.00 33.01 28.86 2k39 s GLN 2 CO 0.00 0.60 -0.11 0.96 -1.32 0.00 0.00 175.29 175.42 2k39 s ILE 3 N -0.56 1.00 0.03 3.63 -4.36 -0.55 -0.79 121.20 119.60 2k39 s ILE 3 Ca 0.11 -1.64 0.08 0.00 -0.26 0.00 0.00 60.65 58.93 2k39 s ILE 3 Cb -0.12 -1.38 -0.03 0.00 1.25 0.00 0.00 42.46 42.19 2k39 s ILE 3 CO 0.02 -0.53 -0.24 -0.36 0.24 0.00 0.00 174.94 174.07 2k39 s PHE 4 N -2.37 2.40 -0.17 1.37 0.08 -1.04 -1.18 117.98 117.07 2k39 s PHE 4 Ca 0.06 -0.37 0.00 0.00 0.12 0.00 0.00 56.93 56.74 2k39 s PHE 4 Cb -0.03 -1.43 0.04 0.00 -0.57 0.00 0.00 43.02 41.02 2k39 s PHE 4 CO 0.01 0.14 -0.08 0.08 -0.10 0.00 0.00 175.22 175.27 2k39 s VAL 5 N -0.81 1.34 -0.24 -0.44 1.01 -0.70 -0.60 120.40 119.95 2k39 s VAL 5 Ca 0.12 -0.74 -0.19 0.00 0.00 0.00 0.00 61.98 61.17 2k39 s VAL 5 Cb -0.10 -1.44 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 2k39 s VAL 5 CO 0.02 0.19 0.58 -0.75 0.00 0.00 0.00 175.10 175.14 2k39 s LYS 6 N 1.54 4.12 0.62 2.72 2.20 0.78 -0.48 119.74 131.24 2k39 s LYS 6 Ca 0.01 0.46 -0.10 0.00 -0.36 0.00 0.00 55.97 55.98 2k39 s LYS 6 Cb -0.15 -3.63 -0.03 0.00 -1.51 0.00 0.00 37.83 32.51 2k39 s LYS 6 CO -0.08 -0.34 1.01 0.95 -0.36 0.00 0.00 175.35 176.53 2k39 s THR 7 N 2.26 4.49 0.17 3.43 -4.23 0.94 -1.50 115.64 121.20 2k39 s THR 7 Ca 0.24 0.71 -0.15 0.00 -1.18 0.00 0.00 61.69 61.32 2k39 s THR 7 Cb -0.16 -3.79 0.05 0.00 1.34 0.00 0.00 72.50 69.94 2k39 s THR 7 CO 0.09 -1.01 1.83 0.25 -0.54 0.00 0.00 174.62 175.24 2k39 h LEU 8 N -0.31 0.55 -2.10 4.79 7.12 -1.86 -0.25 115.31 123.25 2k39 h LEU 8 Ca -0.45 -0.02 0.00 0.00 0.13 0.00 0.00 57.88 57.55 2k39 h LEU 8 Cb 1.20 -0.14 0.00 0.00 -0.53 0.00 0.00 40.66 41.20 2k39 h LEU 8 CO 0.62 0.40 0.02 0.71 -0.13 0.00 0.00 178.44 180.07 2k39 h THR 9 N 0.65 0.00 0.00 1.05 1.35 -1.96 -3.44 112.91 110.56 2k39 h THR 9 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.04 2k39 h THR 9 Cb -0.07 0.70 0.00 0.00 -1.73 0.00 0.00 68.15 67.05 2k39 h THR 9 CO -0.04 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.84 2k39 n GLY 10 N -1.20 0.28 3.76 5.82 0.00 -0.12 -5.11 105.19 108.63 2k39 n GLY 10 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 4.50 -0.17 1.61 2.20 -1.16 -4.71 119.74 122.02 2k39 s LYS 11 Ca 0.00 1.72 0.01 0.00 -0.36 0.00 0.00 55.97 57.35 2k39 s LYS 11 Cb 0.00 -3.01 0.02 0.00 -1.51 0.00 0.00 37.83 33.33 2k39 s LYS 11 CO 0.00 0.11 -0.21 0.99 -0.36 0.00 0.00 175.35 175.89 2k39 s THR 12 N -1.30 2.05 0.34 3.43 2.01 -1.26 -0.04 115.64 120.86 2k39 s THR 12 Ca 0.48 -0.95 -0.04 0.00 0.31 0.00 0.00 61.69 61.50 2k39 s THR 12 Cb -0.29 -1.84 -0.05 0.00 0.01 0.00 0.00 72.50 70.33 2k39 s THR 12 CO 0.37 0.54 0.60 -0.63 -0.69 0.00 0.00 174.62 174.81 2k39 s ILE 13 N 1.14 5.01 -0.11 1.82 1.01 0.37 -4.94 121.20 125.51 2k39 s ILE 13 Ca 0.01 -0.01 0.01 0.00 0.00 0.00 0.00 60.65 60.67 2k39 s ILE 13 Cb -0.14 -3.78 0.02 0.00 0.01 0.00 0.00 42.46 38.57 2k39 s ILE 13 CO -0.09 -0.46 -0.14 0.28 0.00 0.00 0.00 174.94 174.52 2k39 s THR 14 N -2.25 1.40 0.12 2.92 -1.32 -1.26 -1.71 115.64 113.53 2k39 s THR 14 Ca 0.44 -0.58 0.09 0.00 -1.21 0.00 0.00 61.69 60.44 2k39 s THR 14 Cb -0.10 -1.29 -0.04 0.00 -1.51 0.00 0.00 72.50 69.56 2k39 s THR 14 CO 0.33 0.42 -0.24 -0.76 -2.21 0.00 0.00 174.62 172.17 2k39 s LEU 15 N 1.07 2.31 -0.35 9.08 1.43 -0.32 -5.00 118.68 126.90 2k39 s LEU 15 Ca -0.05 -0.72 -0.09 0.00 -1.03 0.00 0.00 54.13 52.24 2k39 s LEU 15 Cb -0.15 -1.03 0.03 0.00 0.03 0.00 0.00 46.19 45.07 2k39 s LEU 15 CO -0.02 0.11 0.15 -0.70 0.23 0.00 0.00 176.35 176.12 2k39 s GLU 16 N -1.99 2.81 -0.04 1.70 -6.30 -1.26 -1.49 118.70 112.13 2k39 s GLU 16 Ca 0.10 -1.07 0.06 0.00 -2.50 0.00 0.00 54.97 51.56 2k39 s GLU 16 Cb -0.10 -3.58 -0.01 0.00 0.00 0.00 0.00 34.13 30.44 2k39 s GLU 16 CO 0.05 -0.64 -0.22 0.08 0.02 0.00 0.00 175.26 174.56 2k39 s VAL 17 N 1.49 1.75 -0.04 3.70 1.01 -0.25 -4.94 120.40 123.12 2k39 s VAL 17 Ca 0.01 -0.91 -0.12 0.00 0.00 0.00 0.00 61.98 60.95 2k39 s VAL 17 Cb -0.19 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 2k39 s VAL 17 CO 0.05 0.49 0.32 -1.61 0.00 0.00 0.00 175.10 174.36 2k39 s GLU 18 N -0.20 3.80 0.53 2.72 0.41 -1.26 -0.02 118.70 124.68 2k39 s GLU 18 Ca -0.00 0.24 0.27 0.00 -0.41 0.00 0.00 54.97 55.07 2k39 s GLU 18 Cb -0.11 -3.22 1.42 0.00 -1.78 0.00 0.00 34.13 30.43 2k39 s GLU 18 CO 0.02 0.69 1.97 -1.35 -0.49 0.00 0.00 175.26 176.09 2k39 h PRO 19 N 4.91 0.00 0.00 0.39 0.11 -1.97 -1.21 132.00 134.24 2k39 h PRO 19 Ca -0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2k39 h PRO 19 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2k39 h PRO 19 CO 0.61 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.83 2k39 n SER 20 N -4.34 0.00 -4.79 -2.05 7.64 -1.26 -1.27 113.62 107.56 2k39 n SER 20 Ca 0.12 -0.36 -0.36 0.00 1.01 0.00 0.00 58.87 59.28 2k39 n SER 20 Cb 0.70 -0.20 -0.04 0.00 -1.01 0.00 0.00 64.21 63.65 2k39 n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2k39 s ASP 21 N -2.40 6.69 0.43 6.43 1.01 -0.46 -4.75 116.67 123.61 2k39 s ASP 21 Ca 0.32 1.98 -0.01 0.00 0.71 0.00 0.00 52.55 55.56 2k39 s ASP 21 Cb 0.20 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 41.53 2k39 s ASP 21 CO 0.41 -0.54 0.67 0.42 0.21 0.00 0.00 175.17 176.34 2k39 s THR 22 N -1.76 4.51 0.57 -1.27 -4.23 -1.26 -2.80 115.64 109.40 2k39 s THR 22 Ca 0.60 -0.32 0.27 0.00 -1.18 0.00 0.00 61.69 61.06 2k39 s THR 22 Cb -0.20 -3.68 0.36 0.00 1.34 0.00 0.00 72.50 70.33 2k39 s THR 22 CO 0.25 -0.51 2.08 0.40 -0.54 0.00 0.00 174.62 176.29 2k39 h ILE 23 N 0.44 0.55 -0.32 2.99 1.08 -1.82 0.06 117.51 120.50 2k39 h ILE 23 Ca -0.47 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 63.93 2k39 h ILE 23 Cb 1.23 0.83 -0.02 0.00 -3.07 0.00 0.00 36.82 35.79 2k39 h ILE 23 CO 0.60 0.00 -0.09 1.05 -0.69 0.00 0.00 178.15 179.01 2k39 h GLU 24 N 0.00 0.53 0.00 2.37 4.11 -1.93 -0.67 114.58 118.99 2k39 h GLU 24 Ca 0.11 -0.15 -0.18 0.00 0.07 0.00 0.00 59.36 59.22 2k39 h GLU 24 Cb 0.56 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2k39 h GLU 24 CO -0.00 0.63 -0.85 -0.91 0.07 0.00 0.00 179.01 177.95 2k39 h ASN 25 N 0.50 0.00 0.55 3.06 4.21 -1.35 -1.98 115.58 120.57 2k39 h ASN 25 Ca 0.10 0.00 -0.29 0.00 1.21 0.00 0.00 56.30 57.32 2k39 h ASN 25 Cb 0.47 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.66 2k39 h ASN 25 CO 0.03 0.85 -1.40 -0.37 -1.29 0.00 0.00 177.43 175.25 2k39 h VAL 26 N 0.00 1.31 -0.53 2.81 -1.51 -1.51 -3.20 116.25 113.62 2k39 h VAL 26 Ca -0.01 -2.93 0.07 0.00 -1.23 0.00 0.00 66.70 62.61 2k39 h VAL 26 Cb 1.55 2.83 -0.06 0.00 -2.13 0.00 0.00 31.29 33.49 2k39 h VAL 26 CO 0.11 0.85 0.21 0.11 -1.23 0.00 0.00 177.57 177.61 2k39 h LYS 27 N 0.07 0.39 0.00 5.19 1.57 -1.06 -2.91 116.57 119.81 2k39 h LYS 27 Ca -0.19 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2k39 h LYS 27 Cb 1.99 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 34.21 2k39 h LYS 27 CO 0.18 0.26 0.00 0.00 -0.57 0.00 0.00 179.45 179.31 2k39 h ALA 28 N 1.34 1.00 0.15 3.86 0.00 -1.44 -2.24 119.26 121.93 2k39 h ALA 28 Ca 0.25 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.92 2k39 h ALA 28 Cb 0.26 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.07 2k39 h ALA 28 CO -0.24 0.00 -1.13 0.87 0.00 0.00 0.00 179.25 178.74 2k39 h LYS 29 N 0.00 0.31 -0.81 0.00 1.57 -1.52 -1.79 116.57 114.33 2k39 h LYS 29 Ca 0.00 -0.53 0.20 0.00 -1.87 0.00 0.00 60.65 58.45 2k39 h LYS 29 Cb 0.81 0.20 -0.14 0.00 0.08 0.00 0.00 32.23 33.18 2k39 h LYS 29 CO 0.00 1.25 0.06 0.82 -0.57 0.00 0.00 179.45 181.02 2k39 h ILE 30 N -0.28 0.30 0.01 1.86 2.04 -1.46 -2.06 117.51 117.92 2k39 h ILE 30 Ca -0.22 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.60 2k39 h ILE 30 Cb 1.76 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 2k39 h ILE 30 CO 0.13 0.02 -0.01 -0.61 0.00 0.00 0.00 178.15 177.68 2k39 h GLN 31 N 0.12 -0.03 -0.79 2.37 4.15 -1.08 -1.02 115.11 118.84 2k39 h GLN 31 Ca 0.47 0.00 0.19 0.00 0.77 0.00 0.00 58.65 60.07 2k39 h GLN 31 Cb 0.87 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.52 2k39 h GLN 31 CO -0.69 -0.02 0.54 0.22 -1.93 0.00 0.00 178.83 176.94 2k39 h ASP 32 N -0.03 0.26 0.00 -0.69 3.58 -1.04 -0.27 116.42 118.23 2k39 h ASP 32 Ca 0.00 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.48 2k39 h ASP 32 Cb 0.03 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2k39 h ASP 32 CO -0.01 0.12 -0.02 0.11 -2.88 0.00 0.00 179.24 176.56 2k39 h LYS 33 N 0.27 0.00 0.00 0.28 1.79 -1.26 -3.45 116.57 114.20 2k39 h LYS 33 Ca 0.39 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 58.61 2k39 h LYS 33 Cb 1.12 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.73 2k39 h LYS 33 CO -0.10 0.00 -2.08 0.39 -1.08 0.00 0.00 179.45 176.58 2k39 n GLU 34 N -3.20 0.67 -0.24 3.15 -0.58 -0.40 -5.05 120.64 114.99 2k39 n GLU 34 Ca -0.00 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2k39 n GLU 34 Cb 0.01 -1.59 0.00 0.00 -0.57 0.00 0.00 31.44 29.28 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 1.57 0.82 3.67 0.62 0.00 -0.12 -5.03 105.19 106.71 2k39 n GLY 35 Ca -0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.11 4.79 -0.09 -0.61 -1.09 -1.26 -4.99 121.20 115.84 2k39 s ILE 36 Ca 0.00 1.84 -0.30 0.00 -2.23 0.00 0.00 60.65 59.97 2k39 s ILE 36 Cb 0.00 -4.23 -0.04 0.00 -1.58 0.00 0.00 42.46 36.61 2k39 s ILE 36 CO 0.00 -0.06 1.46 -2.16 -1.23 0.00 0.00 174.94 172.95 2k39 s PRO 37 N 2.55 4.22 0.22 2.79 0.04 -1.26 -4.35 135.00 139.22 2k39 s PRO 37 Ca 0.42 1.94 0.01 0.00 0.04 0.00 0.00 61.00 63.41 2k39 s PRO 37 Cb -0.16 -3.83 0.54 0.00 0.04 0.00 0.00 34.50 31.09 2k39 s PRO 37 CO 0.11 -0.74 1.13 -2.30 0.04 0.00 0.00 177.00 175.24 2k39 n PRO 38 N 6.62 -0.06 -0.28 0.56 -0.02 -1.26 -1.50 135.00 139.06 2k39 n PRO 38 Ca 0.15 1.09 0.02 0.00 -2.02 0.00 0.00 63.50 62.74 2k39 n PRO 38 Cb 0.44 -1.72 0.15 0.00 -0.02 0.00 0.00 33.50 32.35 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 0.67 0.28 2.55 3.58 -2.00 -2.56 116.42 118.95 2k39 h ASP 39 Ca 0.43 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.93 2k39 h ASP 39 Cb 0.88 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.84 2k39 h ASP 39 CO -0.69 0.40 0.00 0.00 -2.88 0.00 0.00 179.24 176.07 2k39 n GLN 40 N -4.74 0.69 -3.10 0.28 6.02 -0.56 -4.79 117.38 111.18 2k39 n GLN 40 Ca 0.13 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.74 2k39 n GLN 40 Cb 0.25 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.95 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 -2.29 4.36 -0.25 -1.09 -0.21 -0.96 0.24 119.66 119.46 2k39 s GLN 41 Ca 0.37 0.95 -0.03 0.00 0.02 0.00 0.00 55.36 56.67 2k39 s GLN 41 Cb 0.21 -3.11 0.11 0.00 1.00 0.00 0.00 33.01 31.21 2k39 s GLN 41 CO 0.40 0.52 0.24 0.50 -2.12 0.00 0.00 175.29 174.84 2k39 s ARG 42 N -1.45 0.25 -0.39 2.91 3.52 -0.63 -4.88 118.95 118.28 2k39 s ARG 42 Ca 0.37 -0.04 -0.17 0.00 -0.13 0.00 0.00 55.73 55.76 2k39 s ARG 42 Cb -0.20 -0.98 0.01 0.00 -1.56 0.00 0.00 34.95 32.22 2k39 s ARG 42 CO 0.23 -0.86 0.42 -0.51 -0.81 0.00 0.00 175.30 173.77 2k39 s LEU 43 N 2.31 4.65 0.18 -0.88 1.43 -1.26 -1.50 118.68 123.61 2k39 s LEU 43 Ca 0.08 -0.44 -0.22 0.00 -1.03 0.00 0.00 54.13 52.52 2k39 s LEU 43 Cb -0.15 -2.40 -0.08 0.00 0.03 0.00 0.00 46.19 43.59 2k39 s LEU 43 CO -0.24 -0.49 0.73 -0.63 0.23 0.00 0.00 176.35 175.94 2k39 s ILE 44 N 2.14 4.50 -0.14 -0.59 1.01 0.82 -2.35 121.20 126.59 2k39 s ILE 44 Ca 0.13 1.46 -0.05 0.00 0.00 0.00 0.00 60.65 62.19 2k39 s ILE 44 Cb -0.17 -3.99 0.07 0.00 0.01 0.00 0.00 42.46 38.39 2k39 s ILE 44 CO 0.13 0.39 0.27 0.12 0.00 0.00 0.00 174.94 175.85 2k39 s PHE 45 N -1.30 -0.44 -1.47 3.97 5.36 -0.76 -0.52 117.98 122.83 2k39 s PHE 45 Ca 0.38 0.94 0.00 0.00 -0.96 0.00 0.00 56.93 57.29 2k39 s PHE 45 Cb -0.20 -0.04 0.00 0.00 -0.34 0.00 0.00 43.02 42.44 2k39 s PHE 45 CO 0.23 -0.39 0.00 0.00 -1.46 0.00 0.00 175.22 173.60 2k39 n ALA 46 N 5.35 -0.27 0.00 11.12 0.00 -1.26 -1.93 120.51 133.52 2k39 n ALA 46 Ca -0.06 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2k39 n ALA 46 Cb 0.50 -1.61 0.00 0.00 0.00 0.00 0.00 19.45 18.34 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 -1.15 3.33 3.89 0.00 0.00 -1.26 -5.06 105.19 104.94 2k39 n GLY 47 Ca -0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2k39 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k39 s LYS 48 N -0.72 3.58 -0.08 1.61 -2.85 -0.81 -5.08 119.74 115.40 2k39 s LYS 48 Ca 0.00 -0.13 -0.17 0.00 -1.00 0.00 0.00 55.97 54.67 2k39 s LYS 48 Cb 0.00 -2.99 -0.05 0.00 -2.06 0.00 0.00 37.83 32.73 2k39 s LYS 48 CO 0.00 0.58 0.45 -1.14 0.10 0.00 0.00 175.35 175.34 2k39 s GLN 49 N -2.18 4.21 -0.35 1.78 -0.44 -1.26 -1.82 119.66 119.60 2k39 s GLN 49 Ca 0.33 0.43 -0.28 0.00 -2.50 0.00 0.00 55.36 53.34 2k39 s GLN 49 Cb -0.13 -3.37 -0.01 0.00 -1.64 0.00 0.00 33.01 27.87 2k39 s GLN 49 CO 0.21 0.34 1.68 -0.51 0.50 0.00 0.00 175.29 177.51 2k39 s LEU 50 N 0.05 3.53 0.44 3.68 1.02 -0.99 -5.00 118.68 121.40 2k39 s LEU 50 Ca 0.25 1.16 -0.23 0.00 0.02 0.00 0.00 54.13 55.33 2k39 s LEU 50 Cb -0.16 -3.52 -0.08 0.00 0.02 0.00 0.00 46.19 42.45 2k39 s LEU 50 CO 0.11 -1.62 1.07 -0.70 0.02 0.00 0.00 176.35 175.23 2k39 s GLU 51 N 5.44 3.97 0.37 1.70 2.56 -1.26 -4.76 118.70 126.71 2k39 s GLU 51 Ca 0.74 1.52 -0.21 0.00 0.00 0.00 0.00 54.97 57.02 2k39 s GLU 51 Cb -0.20 -2.38 -0.10 0.00 2.00 0.00 0.00 34.13 33.45 2k39 s GLU 51 CO 0.33 -0.31 0.90 -0.51 -0.56 0.00 0.00 175.26 175.11 2k39 s ASP 52 N -1.64 7.04 0.00 -1.70 1.01 -1.26 -3.50 116.67 116.62 2k39 s ASP 52 Ca 0.62 1.65 0.00 0.00 0.71 0.00 0.00 52.55 55.53 2k39 s ASP 52 Cb -0.22 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.19 2k39 s ASP 52 CO 0.27 -0.22 0.00 0.61 0.21 0.00 0.00 175.17 176.03 2k39 n GLY 53 N -0.15 2.53 3.82 0.21 0.00 -1.26 -5.09 105.19 105.25 2k39 n GLY 53 Ca 0.04 -0.71 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 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 1.35 0.50 1.61 0.52 -1.23 -4.90 118.95 116.80 2k39 s ARG 54 Ca 0.00 0.25 0.08 0.00 -0.52 0.00 0.00 55.73 55.54 2k39 s ARG 54 Cb 0.00 -1.87 0.04 0.00 0.52 0.00 0.00 34.95 33.64 2k39 s ARG 54 CO 0.00 -2.04 0.58 0.95 0.02 0.00 0.00 175.30 174.81 2k39 s THR 55 N -3.36 2.36 0.08 0.02 -4.23 -1.26 -2.39 115.64 106.87 2k39 s THR 55 Ca 0.63 -1.16 0.09 0.00 -1.18 0.00 0.00 61.69 60.07 2k39 s THR 55 Cb -0.14 -2.52 -0.14 0.00 1.34 0.00 0.00 72.50 71.03 2k39 s THR 55 CO 0.52 0.00 1.34 -0.07 -0.54 0.00 0.00 174.62 175.87 2k39 h LEU 56 N 0.57 0.00 -0.73 4.79 -0.00 -1.44 -3.24 115.31 115.26 2k39 h LEU 56 Ca -0.36 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 57.39 2k39 h LEU 56 Cb 1.28 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.93 2k39 h LEU 56 CO 0.48 0.88 -0.55 -1.28 -0.00 0.00 0.00 178.44 177.97 2k39 h SER 57 N 0.00 0.26 1.38 -0.43 0.87 -1.49 -2.06 113.55 112.08 2k39 h SER 57 Ca -0.01 -0.14 -0.05 0.00 -1.23 0.00 0.00 61.79 60.37 2k39 h SER 57 Cb 1.64 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 63.52 2k39 h SER 57 CO 0.11 0.76 -0.22 0.44 -0.53 0.00 0.00 176.83 177.39 2k39 h ASP 58 N 0.18 0.00 -0.02 6.23 3.32 -1.86 -2.92 116.42 121.36 2k39 h ASP 58 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2k39 h ASP 58 Cb 1.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.58 2k39 h ASP 58 CO 0.08 0.22 0.00 -1.22 -1.72 0.00 0.00 179.24 176.61 2k39 n TYR 59 N -3.23 0.01 -3.73 4.55 4.01 -0.85 -4.98 117.16 112.93 2k39 n TYR 59 Ca 0.02 -0.01 -0.19 0.00 -0.16 0.00 0.00 57.90 57.56 2k39 n TYR 59 Cb 0.53 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.57 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 -0.18 -1.82 -0.10 7.72 5.15 -0.84 -4.88 115.26 120.32 2k39 n ASN 60 Ca 0.20 -0.54 -0.14 0.00 -0.60 0.00 0.00 54.58 53.50 2k39 n ASN 60 Cb 0.28 -0.68 -0.14 0.00 -0.53 0.00 0.00 39.78 38.70 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 2k39 n ILE 61 N -2.48 1.48 -3.58 -1.44 5.41 -1.26 -5.08 119.36 112.41 2k39 n ILE 61 Ca -0.07 -0.72 0.00 0.00 1.00 0.00 0.00 62.75 62.97 2k39 n ILE 61 Cb 0.25 -1.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.18 2k39 n ILE 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2k39 n GLN 62 N -3.04 0.00 -2.19 0.38 1.13 -1.26 -4.94 117.38 107.46 2k39 n GLN 62 Ca -0.37 0.00 -0.31 0.00 -1.94 0.00 0.00 57.00 54.38 2k39 n GLN 62 Cb 1.07 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 31.42 2k39 n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 2k39 s LYS 63 N 0.00 3.68 -0.26 -1.09 -2.85 -1.26 -4.64 119.74 113.32 2k39 s LYS 63 Ca 0.00 0.69 0.00 0.00 -1.00 0.00 0.00 55.97 55.66 2k39 s LYS 63 Cb 0.00 -2.16 0.00 0.00 -2.06 0.00 0.00 37.83 33.61 2k39 s LYS 63 CO 0.00 -0.40 0.00 -1.91 0.10 0.00 0.00 175.35 173.14 2k39 n GLU 64 N -2.29 -1.28 -4.16 1.78 2.13 0.03 -4.95 120.64 111.89 2k39 n GLU 64 Ca 0.05 0.45 -0.33 0.00 0.66 0.00 0.00 57.16 57.99 2k39 n GLU 64 Cb 0.54 -4.48 -0.08 0.00 0.27 0.00 0.00 31.44 27.70 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 -2.15 5.54 -0.42 4.31 0.01 -1.26 -4.81 113.70 114.92 2k39 s SER 65 Ca 0.00 0.13 -0.12 0.00 1.31 0.00 0.00 55.95 57.26 2k39 s SER 65 Cb 0.00 -1.57 0.06 0.00 0.21 0.00 0.00 66.02 64.72 2k39 s SER 65 CO 0.00 0.29 0.29 -0.89 0.41 0.00 0.00 173.24 173.34 2k39 s THR 66 N -1.13 4.73 0.55 1.44 2.01 -1.26 -2.50 115.64 119.48 2k39 s THR 66 Ca 0.21 -1.10 -0.17 0.00 0.31 0.00 0.00 61.69 60.94 2k39 s THR 66 Cb -0.12 -3.78 -0.06 0.00 0.01 0.00 0.00 72.50 68.55 2k39 s THR 66 CO 0.11 -0.45 1.04 -0.76 -0.69 0.00 0.00 174.62 173.87 2k39 s LEU 67 N 1.55 3.60 -0.46 4.42 1.02 0.23 -4.91 118.68 124.12 2k39 s LEU 67 Ca 0.03 1.78 0.01 0.00 0.02 0.00 0.00 54.13 55.98 2k39 s LEU 67 Cb -0.22 -4.53 0.12 0.00 0.02 0.00 0.00 46.19 41.58 2k39 s LEU 67 CO 0.05 -0.96 0.22 -1.00 0.02 0.00 0.00 176.35 174.68 2k39 s HIS 68 N -2.39 3.48 -0.06 0.29 3.76 0.32 -0.16 115.29 120.53 2k39 s HIS 68 Ca 0.63 -2.90 -0.30 0.00 -0.15 0.00 0.00 55.06 52.35 2k39 s HIS 68 Cb -0.15 -3.00 -0.06 0.00 1.11 0.00 0.00 32.58 30.48 2k39 s HIS 68 CO 0.32 -0.87 1.84 -1.17 -0.85 0.00 0.00 174.74 174.01 2k39 s LEU 69 N 0.38 4.21 0.11 0.89 1.98 -0.56 -0.13 118.68 125.56 2k39 s LEU 69 Ca 0.13 2.29 0.08 0.00 -2.89 0.00 0.00 54.13 53.74 2k39 s LEU 69 Cb -0.22 -3.53 -0.04 0.00 0.66 0.00 0.00 46.19 43.06 2k39 s LEU 69 CO -0.04 -1.14 -0.20 -0.69 -1.89 0.00 0.00 176.35 172.39 2k39 s VAL 70 N 4.86 1.67 0.26 1.68 1.01 -0.56 -4.09 120.40 125.22 2k39 s VAL 70 Ca 0.82 -1.58 0.05 0.00 0.00 0.00 0.00 61.98 61.27 2k39 s VAL 70 Cb -0.36 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2k39 s VAL 70 CO 0.35 -0.12 0.36 -0.76 0.00 0.00 0.00 175.10 174.93 2k39 s LEU 71 N -2.02 4.22 -0.39 3.92 1.02 -1.26 -1.61 118.68 122.56 2k39 s LEU 71 Ca 0.07 -0.00 -0.06 0.00 0.02 0.00 0.00 54.13 54.16 2k39 s LEU 71 Cb -0.09 -2.79 0.08 0.00 0.02 0.00 0.00 46.19 43.41 2k39 s LEU 71 CO 0.04 -0.12 0.19 -0.60 0.02 0.00 0.00 176.35 175.88 2k39 s ARG 72 N -4.00 2.40 -0.24 1.70 3.52 0.14 -4.93 118.95 117.55 2k39 s ARG 72 Ca 0.36 -1.51 -0.15 0.00 -0.13 0.00 0.00 55.73 54.29 2k39 s ARG 72 Cb -0.09 -3.60 -0.04 0.00 -1.56 0.00 0.00 34.95 29.67 2k39 s ARG 72 CO 0.29 -0.91 0.39 -0.51 -0.81 0.00 0.00 175.30 173.75 2k39 s LEU 73 N 1.31 4.09 0.00 -0.88 2.01 -1.26 -4.81 118.68 119.14 2k39 s LEU 73 Ca 0.03 0.40 0.00 0.00 0.01 0.00 0.00 54.13 54.57 2k39 s LEU 73 Cb -0.22 -2.48 0.00 0.00 0.01 0.00 0.00 46.19 43.50 2k39 s LEU 73 CO -0.00 -0.15 0.00 0.54 1.01 0.00 0.00 176.35 177.75 2k39 n ARG 74 N 4.98 0.00 0.00 1.70 1.74 -1.26 -3.61 116.66 120.21 2k39 n ARG 74 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2k39 n ARG 74 Cb 0.51 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.95 2k39 n ARG 74 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k39 n GLY 75 N 0.00 0.00 0.00 -0.13 0.00 -1.26 -5.21 105.19 98.59 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