#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 4.15 0.29 3.17 -0.21 -1.26 -0.04 119.66 125.75 2k39 s GLN 2 Ca 0.00 0.16 0.08 0.00 0.02 0.00 0.00 55.36 55.62 2k39 s GLN 2 Cb 0.00 -3.55 -0.04 0.00 1.00 0.00 0.00 33.01 30.43 2k39 s GLN 2 CO 0.00 -0.06 0.17 0.96 -2.12 0.00 0.00 175.29 174.25 2k39 s ILE 3 N 1.38 3.85 -0.08 1.08 -4.36 0.19 -0.66 121.20 122.59 2k39 s ILE 3 Ca 0.18 -1.53 -0.04 0.00 -0.26 0.00 0.00 60.65 58.99 2k39 s ILE 3 Cb -0.15 -3.19 -0.04 0.00 1.25 0.00 0.00 42.46 40.34 2k39 s ILE 3 CO 0.08 -0.29 0.11 -0.36 0.24 0.00 0.00 174.94 174.72 2k39 s PHE 4 N -2.25 3.47 -0.28 1.37 0.08 -0.06 -0.22 117.98 120.09 2k39 s PHE 4 Ca 0.35 0.39 -0.05 0.00 0.12 0.00 0.00 56.93 57.74 2k39 s PHE 4 Cb -0.06 -1.87 0.01 0.00 -0.57 0.00 0.00 43.02 40.53 2k39 s PHE 4 CO 0.24 0.65 0.04 0.08 -0.10 0.00 0.00 175.22 176.12 2k39 s VAL 5 N -1.07 3.65 -0.54 -0.44 1.01 0.15 -1.44 120.40 121.71 2k39 s VAL 5 Ca 0.18 -0.76 -0.26 0.00 0.00 0.00 0.00 61.98 61.14 2k39 s VAL 5 Cb -0.12 -2.86 0.03 0.00 0.00 0.00 0.00 36.38 33.43 2k39 s VAL 5 CO 0.07 0.14 1.05 -0.75 0.00 0.00 0.00 175.10 175.61 2k39 s LYS 6 N 1.45 3.47 0.63 2.72 2.20 -0.08 -1.73 119.74 128.40 2k39 s LYS 6 Ca 0.02 0.08 -0.14 0.00 -0.36 0.00 0.00 55.97 55.56 2k39 s LYS 6 Cb -0.17 -4.00 -0.02 0.00 -1.51 0.00 0.00 37.83 32.13 2k39 s LYS 6 CO 0.00 -1.51 1.06 0.95 -0.36 0.00 0.00 175.35 175.50 2k39 s THR 7 N 4.35 3.81 0.34 3.43 -4.23 -0.34 -3.74 115.64 119.26 2k39 s THR 7 Ca 0.38 0.78 0.07 0.00 -1.18 0.00 0.00 61.69 61.74 2k39 s THR 7 Cb -0.10 -3.35 0.31 0.00 1.34 0.00 0.00 72.50 70.70 2k39 s THR 7 CO 0.24 -0.58 1.87 0.25 -0.54 0.00 0.00 174.62 175.86 2k39 h LEU 8 N 0.09 0.72 -1.74 4.79 5.85 -1.86 -2.12 115.31 121.05 2k39 h LEU 8 Ca -0.46 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.27 2k39 h LEU 8 Cb 1.22 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.14 2k39 h LEU 8 CO 0.57 0.38 -0.13 0.71 -0.34 0.00 0.00 178.44 179.62 2k39 h THR 9 N 0.77 0.50 0.00 1.05 1.35 -1.97 -3.47 112.91 111.14 2k39 h THR 9 Ca 0.44 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 2k39 h THR 9 Cb 0.61 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 2k39 h THR 9 CO -0.20 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 175.81 2k39 n GLY 10 N -0.45 2.24 3.77 5.82 0.00 -0.80 -5.11 105.19 110.67 2k39 n GLY 10 Ca -0.01 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 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 4.25 -0.12 1.61 2.20 -1.25 -4.82 119.74 121.61 2k39 s LYS 11 Ca 0.00 2.37 0.02 0.00 -0.36 0.00 0.00 55.97 57.99 2k39 s LYS 11 Cb 0.00 -3.04 -0.01 0.00 -1.51 0.00 0.00 37.83 33.27 2k39 s LYS 11 CO 0.00 -0.36 -0.18 0.99 -0.36 0.00 0.00 175.35 175.44 2k39 s THR 12 N -0.91 2.62 0.01 3.43 2.01 -1.26 -1.20 115.64 120.34 2k39 s THR 12 Ca 0.52 -0.82 0.05 0.00 0.31 0.00 0.00 61.69 61.76 2k39 s THR 12 Cb -0.43 -2.06 -0.03 0.00 0.01 0.00 0.00 72.50 69.99 2k39 s THR 12 CO 0.55 0.54 -0.13 0.27 -0.69 0.00 0.00 174.62 175.16 2k39 s ILE 13 N 0.37 3.17 -0.10 1.82 -4.36 -0.70 -5.00 121.20 116.40 2k39 s ILE 13 Ca -0.14 -0.94 -0.19 0.00 -0.26 0.00 0.00 60.65 59.12 2k39 s ILE 13 Cb -0.17 -2.33 -0.04 0.00 1.25 0.00 0.00 42.46 41.17 2k39 s ILE 13 CO 0.07 0.41 0.53 -0.89 0.24 0.00 0.00 174.94 175.29 2k39 s THR 14 N -0.91 5.15 -0.31 8.37 2.01 -1.26 -0.68 115.64 128.01 2k39 s THR 14 Ca 0.15 1.07 -0.02 0.00 0.31 0.00 0.00 61.69 63.19 2k39 s THR 14 Cb -0.11 -3.87 0.05 0.00 0.01 0.00 0.00 72.50 68.59 2k39 s THR 14 CO 0.05 0.32 0.01 -0.76 -0.69 0.00 0.00 174.62 173.55 2k39 s LEU 15 N 0.60 3.97 -0.31 4.42 1.02 0.69 -4.96 118.68 124.11 2k39 s LEU 15 Ca 0.29 -1.29 -0.29 0.00 0.02 0.00 0.00 54.13 52.85 2k39 s LEU 15 Cb -0.16 -1.73 -0.01 0.00 0.02 0.00 0.00 46.19 44.32 2k39 s LEU 15 CO 0.12 -0.27 1.55 -0.70 0.02 0.00 0.00 176.35 177.06 2k39 s GLU 16 N 1.26 3.65 0.19 1.70 2.12 -1.26 -0.64 118.70 125.73 2k39 s GLU 16 Ca -0.04 1.34 0.01 0.00 0.36 0.00 0.00 54.97 56.63 2k39 s GLU 16 Cb -0.20 -4.04 -0.05 0.00 0.26 0.00 0.00 34.13 30.10 2k39 s GLU 16 CO -0.01 -1.46 0.04 0.14 -0.54 0.00 0.00 175.26 173.42 2k39 s VAL 17 N 5.50 0.57 0.29 3.70 -7.23 0.94 -4.95 120.40 119.21 2k39 s VAL 17 Ca 0.68 -1.98 0.10 0.00 -1.81 0.00 0.00 61.98 58.97 2k39 s VAL 17 Cb -0.20 -2.27 -0.05 0.00 0.56 0.00 0.00 36.38 34.42 2k39 s VAL 17 CO 0.30 -0.32 -0.07 -1.61 -0.31 0.00 0.00 175.10 173.09 2k39 s GLU 18 N -3.97 2.01 0.58 4.82 0.41 -1.26 0.10 118.70 121.39 2k39 s GLU 18 Ca 0.28 -1.65 0.38 0.00 -0.41 0.00 0.00 54.97 53.57 2k39 s GLU 18 Cb 0.07 -1.95 1.83 0.00 -1.78 0.00 0.00 34.13 32.30 2k39 s GLU 18 CO 0.07 0.28 2.13 -1.35 -0.49 0.00 0.00 175.26 175.90 2k39 h PRO 19 N 2.00 0.00 0.00 0.39 0.11 -1.95 -1.09 132.00 131.46 2k39 h PRO 19 Ca -0.42 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.62 2k39 h PRO 19 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2k39 h PRO 19 CO 0.62 0.00 -0.30 0.66 -0.21 0.00 0.00 178.00 178.77 2k39 h SER 20 N 0.00 0.00 -2.18 -2.05 4.64 -1.96 -1.80 113.55 110.20 2k39 h SER 20 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 2k39 h SER 20 Cb 0.25 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.42 2k39 h SER 20 CO 0.00 0.30 0.43 0.47 -0.87 0.00 0.00 176.83 177.16 2k39 n ASP 21 N -3.62 1.94 -4.83 4.97 9.92 -0.41 -4.71 116.55 119.81 2k39 n ASP 21 Ca -0.01 1.14 -0.34 0.00 -0.53 0.00 0.00 54.79 55.05 2k39 n ASP 21 Cb 0.43 -1.30 -0.06 0.00 -0.64 0.00 0.00 41.12 39.55 2k39 n ASP 21 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2k39 s THR 22 N -0.01 4.54 0.29 -3.53 -4.23 -1.26 -1.67 115.64 109.76 2k39 s THR 22 Ca 0.73 1.23 0.03 0.00 -1.18 0.00 0.00 61.69 62.50 2k39 s THR 22 Cb -0.78 -3.68 0.29 0.00 1.34 0.00 0.00 72.50 69.66 2k39 s THR 22 CO 0.50 -0.13 1.70 0.40 -0.54 0.00 0.00 174.62 176.54 2k39 h ILE 23 N 2.12 0.48 -0.38 2.99 1.08 -1.63 -0.13 117.51 122.04 2k39 h ILE 23 Ca -0.48 -0.14 0.04 0.00 -0.39 0.00 0.00 64.86 63.89 2k39 h ILE 23 Cb 1.18 0.04 -0.05 0.00 -3.07 0.00 0.00 36.82 34.93 2k39 h ILE 23 CO 0.64 0.07 -0.25 -0.08 -0.69 0.00 0.00 178.15 177.85 2k39 h GLU 24 N 0.40 -0.03 -0.44 2.37 4.81 -1.90 -1.53 114.58 118.26 2k39 h GLU 24 Ca 0.55 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.75 2k39 h GLU 24 Cb 1.04 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.41 2k39 h GLU 24 CO -0.52 -0.02 0.11 -0.97 -0.73 0.00 0.00 179.01 176.88 2k39 h ASN 25 N -0.03 0.60 -0.29 1.04 -0.73 -1.64 -1.98 115.58 112.56 2k39 h ASN 25 Ca 0.06 -0.09 0.04 0.00 1.87 0.00 0.00 56.30 58.18 2k39 h ASN 25 Cb 0.19 -0.16 -0.03 0.00 0.27 0.00 0.00 38.32 38.59 2k39 h ASN 25 CO -0.37 0.60 0.08 0.58 -0.37 0.00 0.00 177.43 177.94 2k39 h VAL 26 N 0.64 0.89 -1.19 2.57 2.07 -0.79 -1.19 116.25 119.26 2k39 h VAL 26 Ca 0.15 -0.07 0.34 0.00 0.82 0.00 0.00 66.70 67.94 2k39 h VAL 26 Cb 0.23 0.68 -0.09 0.00 -1.52 0.00 0.00 31.29 30.59 2k39 h VAL 26 CO -0.00 0.04 0.79 0.11 0.02 0.00 0.00 177.57 178.52 2k39 h LYS 27 N 0.19 0.20 0.00 1.57 1.57 -0.83 -1.34 116.57 117.94 2k39 h LYS 27 Ca 0.13 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.77 2k39 h LYS 27 Cb 0.12 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2k39 h LYS 27 CO -0.16 0.13 -0.62 0.00 -0.57 0.00 0.00 179.45 178.23 2k39 h ALA 28 N 1.53 0.78 0.13 3.86 0.00 -0.75 -2.31 119.26 122.51 2k39 h ALA 28 Ca 0.66 -0.57 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 2k39 h ALA 28 Cb 2.06 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 19.77 2k39 h ALA 28 CO -0.24 0.78 -0.81 0.87 0.00 0.00 0.00 179.25 179.85 2k39 h LYS 29 N 0.00 0.31 -0.60 0.00 1.57 -0.55 -2.23 116.57 115.07 2k39 h LYS 29 Ca -0.01 -0.51 0.12 0.00 -1.87 0.00 0.00 60.65 58.38 2k39 h LYS 29 Cb 1.25 0.19 -0.11 0.00 0.08 0.00 0.00 32.23 33.64 2k39 h LYS 29 CO 0.08 1.24 -0.08 0.82 -0.57 0.00 0.00 179.45 180.94 2k39 h ILE 30 N -0.34 0.44 0.04 1.86 2.04 -1.29 0.19 117.51 120.45 2k39 h ILE 30 Ca -0.14 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 65.73 2k39 h ILE 30 Cb 1.63 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 2k39 h ILE 30 CO 0.15 0.01 -0.23 -0.61 0.00 0.00 0.00 178.15 177.47 2k39 h GLN 31 N 0.05 -0.37 -0.88 2.37 4.15 -1.52 -0.35 115.11 118.55 2k39 h GLN 31 Ca 0.30 0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.76 2k39 h GLN 31 Cb 0.48 0.08 -0.04 0.00 0.21 0.00 0.00 27.48 28.21 2k39 h GLN 31 CO -0.57 -0.25 0.58 0.22 -1.93 0.00 0.00 178.83 176.88 2k39 h ASP 32 N -0.39 1.01 0.99 -0.69 3.58 -0.59 0.20 116.42 120.52 2k39 h ASP 32 Ca 0.05 -0.02 -0.13 0.00 0.42 0.00 0.00 57.03 57.34 2k39 h ASP 32 Cb 0.45 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.23 2k39 h ASP 32 CO -0.19 0.73 -0.63 0.11 -2.88 0.00 0.00 179.24 176.38 2k39 h LYS 33 N 1.19 0.00 0.00 0.28 6.56 -1.05 -3.41 116.57 120.14 2k39 h LYS 33 Ca 0.33 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.92 2k39 h LYS 33 Cb -0.13 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.53 2k39 h LYS 33 CO -0.07 0.63 0.00 0.39 -2.06 0.00 0.00 179.45 178.33 2k39 n GLU 34 N -3.47 0.00 -0.41 3.15 -0.58 -0.14 -5.03 120.64 114.16 2k39 n GLU 34 Ca 0.00 -0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 2k39 n GLU 34 Cb 0.70 -0.50 0.00 0.00 -0.57 0.00 0.00 31.44 31.08 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 0.00 1.19 3.80 0.62 0.00 0.68 -4.98 105.19 106.50 2k39 n GLY 35 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.04 4.32 0.07 -0.61 1.01 -1.26 -4.99 121.20 116.70 2k39 s ILE 36 Ca 0.00 1.63 -0.30 0.00 0.00 0.00 0.00 60.65 61.98 2k39 s ILE 36 Cb 0.00 -3.84 -0.05 0.00 0.01 0.00 0.00 42.46 38.58 2k39 s ILE 36 CO 0.00 -0.03 1.04 -2.16 0.00 0.00 0.00 174.94 173.78 2k39 s PRO 37 N -2.49 4.58 0.35 2.79 0.04 -1.26 -4.18 135.00 134.82 2k39 s PRO 37 Ca 0.54 1.55 0.24 0.00 0.04 0.00 0.00 61.00 63.37 2k39 s PRO 37 Cb -0.15 -3.38 0.46 0.00 0.04 0.00 0.00 34.50 31.47 2k39 s PRO 37 CO 0.19 0.00 1.62 -1.00 0.04 0.00 0.00 177.00 177.86 2k39 h PRO 38 N 6.17 0.00 0.00 0.56 0.13 -1.95 -3.31 132.00 133.60 2k39 h PRO 38 Ca -0.42 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.66 2k39 h PRO 38 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2k39 h PRO 38 CO 0.75 0.00 -0.23 0.22 -0.23 0.00 0.00 178.00 178.50 2k39 h ASP 39 N 0.00 0.00 1.44 1.44 3.58 -1.96 -2.67 116.42 118.25 2k39 h ASP 39 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2k39 h ASP 39 Cb 0.92 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.97 2k39 h ASP 39 CO 0.00 0.23 -0.23 1.56 -2.88 0.00 0.00 179.24 177.92 2k39 h GLN 40 N 0.00 0.00 -6.49 0.28 4.20 -1.99 -3.46 115.11 107.64 2k39 h GLN 40 Ca -0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.17 2k39 h GLN 40 Cb 1.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.93 2k39 h GLN 40 CO 0.03 0.00 0.57 -0.65 -0.67 0.00 0.00 178.83 178.11 2k39 s GLN 41 N -3.17 4.43 0.04 1.46 -0.21 -1.01 0.19 119.66 121.39 2k39 s GLN 41 Ca 0.08 1.79 -0.08 0.00 0.02 0.00 0.00 55.36 57.17 2k39 s GLN 41 Cb 0.10 -3.34 -0.05 0.00 1.00 0.00 0.00 33.01 30.73 2k39 s GLN 41 CO 0.66 -0.26 0.32 0.50 -2.12 0.00 0.00 175.29 174.40 2k39 s ARG 42 N 1.01 3.65 -0.13 2.91 3.52 -0.12 -4.89 118.95 124.90 2k39 s ARG 42 Ca 0.59 0.03 -0.04 0.00 -0.13 0.00 0.00 55.73 56.18 2k39 s ARG 42 Cb -0.30 -3.05 0.06 0.00 -1.56 0.00 0.00 34.95 30.10 2k39 s ARG 42 CO 0.30 0.61 0.16 -1.17 -0.81 0.00 0.00 175.30 174.38 2k39 s LEU 43 N -1.82 0.02 0.01 -0.88 2.96 -1.26 -2.85 118.68 114.86 2k39 s LEU 43 Ca 0.30 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 54.19 2k39 s LEU 43 Cb -0.14 0.17 -0.01 0.00 0.50 0.00 0.00 46.19 46.71 2k39 s LEU 43 CO 0.17 -0.29 -0.08 0.27 -1.32 0.00 0.00 176.35 175.10 2k39 s ILE 44 N 2.26 0.58 -0.32 6.68 -4.36 -0.67 -3.31 121.20 122.05 2k39 s ILE 44 Ca 0.04 -0.53 -0.02 0.00 -0.26 0.00 0.00 60.65 59.88 2k39 s ILE 44 Cb -0.14 -0.53 0.11 0.00 1.25 0.00 0.00 42.46 43.16 2k39 s ILE 44 CO -0.08 0.01 0.15 0.12 0.24 0.00 0.00 174.94 175.39 2k39 s PHE 45 N -0.50 0.76 -0.30 1.37 5.36 -1.03 -1.33 117.98 122.31 2k39 s PHE 45 Ca -0.00 -1.32 0.00 0.00 -0.96 0.00 0.00 56.93 54.64 2k39 s PHE 45 Cb -0.05 -1.10 0.00 0.00 -0.34 0.00 0.00 43.02 41.54 2k39 s PHE 45 CO 0.00 -0.83 0.00 0.00 -1.46 0.00 0.00 175.22 172.93 2k39 n ALA 46 N 4.74 -0.05 0.00 11.12 0.00 -1.26 -3.00 120.51 132.06 2k39 n ALA 46 Ca 0.01 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2k39 n ALA 46 Cb 0.40 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.13 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 -2.37 3.08 3.72 0.00 0.00 -1.26 -5.09 105.19 103.28 2k39 n GLY 47 Ca -0.03 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.50 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 0.00 4.57 -0.06 1.61 1.02 -1.16 -5.03 119.74 120.69 2k39 s LYS 48 Ca 0.00 1.27 -0.28 0.00 0.02 0.00 0.00 55.97 56.98 2k39 s LYS 48 Cb 0.00 -3.41 -0.03 0.00 -0.52 0.00 0.00 37.83 33.88 2k39 s LYS 48 CO 0.00 0.13 0.90 -0.65 -0.92 0.00 0.00 175.35 174.81 2k39 s GLN 49 N 0.41 4.47 -0.33 1.68 -0.21 -1.26 -2.47 119.66 121.95 2k39 s GLN 49 Ca 0.45 1.24 -0.27 0.00 0.02 0.00 0.00 55.36 56.80 2k39 s GLN 49 Cb -0.21 -3.49 0.01 0.00 1.00 0.00 0.00 33.01 30.32 2k39 s GLN 49 CO 0.26 -0.11 0.99 -0.51 -2.12 0.00 0.00 175.29 173.79 2k39 s LEU 50 N 1.31 3.97 0.18 2.90 1.43 -1.21 -4.99 118.68 122.26 2k39 s LEU 50 Ca 0.46 0.85 -0.30 0.00 -1.03 0.00 0.00 54.13 54.12 2k39 s LEU 50 Cb -0.19 -3.39 -0.08 0.00 0.03 0.00 0.00 46.19 42.56 2k39 s LEU 50 CO 0.22 -0.83 1.08 -0.70 0.23 0.00 0.00 176.35 176.35 2k39 s GLU 51 N 3.50 4.61 -0.02 1.70 2.56 -1.26 -4.96 118.70 124.84 2k39 s GLU 51 Ca 0.41 1.69 -0.32 0.00 0.00 0.00 0.00 54.97 56.76 2k39 s GLU 51 Cb -0.12 -3.28 -0.10 0.00 2.00 0.00 0.00 34.13 32.62 2k39 s GLU 51 CO 0.16 0.10 1.94 -0.25 -0.56 0.00 0.00 175.26 176.66 2k39 n ASP 52 N 2.35 3.88 0.00 -1.70 9.92 -1.26 -2.99 116.55 126.74 2k39 n ASP 52 Ca 0.02 0.92 0.00 0.00 -0.53 0.00 0.00 54.79 55.21 2k39 n ASP 52 Cb 0.46 -1.47 0.00 0.00 -0.64 0.00 0.00 41.12 39.48 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 4.52 0.94 3.87 0.44 0.00 -1.26 -4.95 105.19 108.75 2k39 n GLY 53 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.78 3.80 0.36 1.61 1.81 -1.16 -4.87 118.95 119.73 2k39 s ARG 54 Ca 0.00 0.48 -0.25 0.00 -1.72 0.00 0.00 55.73 54.24 2k39 s ARG 54 Cb 0.00 -2.40 -0.09 0.00 -0.45 0.00 0.00 34.95 32.00 2k39 s ARG 54 CO 0.00 -0.00 1.02 0.95 -0.68 0.00 0.00 175.30 176.58 2k39 s THR 55 N -2.31 3.88 0.52 0.02 -4.23 -1.26 -1.71 115.64 110.55 2k39 s THR 55 Ca 0.51 1.51 0.17 0.00 -1.18 0.00 0.00 61.69 62.70 2k39 s THR 55 Cb -0.10 -3.81 0.28 0.00 1.34 0.00 0.00 72.50 70.21 2k39 s THR 55 CO 0.29 0.07 2.14 -0.07 -0.54 0.00 0.00 174.62 176.52 2k39 h LEU 56 N 2.82 0.00 0.19 4.79 3.38 -1.19 -2.72 115.31 122.60 2k39 h LEU 56 Ca -0.48 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.50 2k39 h LEU 56 Cb 1.21 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 2k39 h LEU 56 CO 0.64 0.00 -0.49 -1.28 0.09 0.00 0.00 178.44 177.40 2k39 h SER 57 N 0.00 -1.43 -0.92 -0.43 0.87 -1.61 -0.08 113.55 109.95 2k39 h SER 57 Ca 0.02 0.15 0.19 0.00 -1.23 0.00 0.00 61.79 60.91 2k39 h SER 57 Cb 0.09 0.52 -0.11 0.00 -0.44 0.00 0.00 62.40 62.46 2k39 h SER 57 CO -0.00 -0.56 0.49 -0.78 -0.53 0.00 0.00 176.83 175.45 2k39 h ASP 58 N -0.77 0.56 0.02 6.23 3.58 -1.78 -2.64 116.42 121.62 2k39 h ASP 58 Ca -0.01 0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.56 2k39 h ASP 58 Cb 0.76 0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.84 2k39 h ASP 58 CO -0.23 0.17 -0.03 -1.22 -2.88 0.00 0.00 179.24 175.05 2k39 n TYR 59 N -4.89 0.00 -3.38 0.28 4.01 -1.11 -4.94 117.16 107.14 2k39 n TYR 59 Ca 0.21 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.74 2k39 n TYR 59 Cb 0.55 -0.02 0.06 0.00 -0.31 0.00 0.00 39.34 39.63 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 -0.09 -5.87 -4.65 7.72 4.13 -0.77 -4.98 115.26 110.75 2k39 n ASN 60 Ca 0.19 -0.44 -0.41 0.00 1.68 0.00 0.00 54.58 55.60 2k39 n ASN 60 Cb 0.32 -4.52 -0.05 0.00 -1.54 0.00 0.00 39.78 33.99 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 -3.25 4.89 0.40 2.41 -1.09 -0.12 -5.00 121.20 119.44 2k39 s ILE 61 Ca 0.48 1.50 0.08 0.00 -2.23 0.00 0.00 60.65 60.47 2k39 s ILE 61 Cb -0.21 -4.08 -0.01 0.00 -1.58 0.00 0.00 42.46 36.58 2k39 s ILE 61 CO 0.59 -0.00 0.44 -1.10 -1.23 0.00 0.00 174.94 173.64 2k39 s GLN 62 N 2.42 2.71 0.28 2.79 -1.52 -1.26 -4.74 119.66 120.34 2k39 s GLN 62 Ca 0.34 -1.36 -0.30 0.00 -1.95 0.00 0.00 55.36 52.09 2k39 s GLN 62 Cb -0.16 -2.56 -0.12 0.00 -0.22 0.00 0.00 33.01 29.95 2k39 s GLN 62 CO 0.10 -0.17 1.56 0.36 -0.25 0.00 0.00 175.29 176.89 2k39 n LYS 63 N -1.64 2.58 -1.41 2.91 2.85 -1.26 -3.27 118.16 118.92 2k39 n LYS 63 Ca 0.04 0.92 -0.14 0.00 -1.05 0.00 0.00 58.31 58.08 2k39 n LYS 63 Cb 0.60 -2.68 -0.06 0.00 -0.65 0.00 0.00 35.03 32.24 2k39 n LYS 63 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 2k39 n GLU 64 N 2.11 -1.12 -2.27 -1.58 0.28 0.16 -4.99 120.64 113.23 2k39 n GLU 64 Ca 0.09 0.99 -0.40 0.00 -0.16 0.00 0.00 57.16 57.69 2k39 n GLU 64 Cb 0.36 -5.15 -0.03 0.00 1.43 0.00 0.00 31.44 28.05 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 2k39 s SER 65 N -2.76 6.79 -0.17 -1.84 0.01 -1.20 -4.81 113.70 109.72 2k39 s SER 65 Ca 0.00 2.45 -0.05 0.00 1.31 0.00 0.00 55.95 59.66 2k39 s SER 65 Cb 0.00 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.57 2k39 s SER 65 CO 0.00 -0.50 -0.01 -0.89 0.41 0.00 0.00 173.24 172.26 2k39 s THR 66 N -1.26 4.15 0.18 1.44 2.01 -1.26 -0.89 115.64 120.02 2k39 s THR 66 Ca 0.51 -0.26 -0.00 0.00 0.31 0.00 0.00 61.69 62.25 2k39 s THR 66 Cb -0.34 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.29 2k39 s THR 66 CO 0.44 0.48 0.35 -0.76 -0.69 0.00 0.00 174.62 174.44 2k39 s LEU 67 N 0.44 4.26 0.27 4.42 1.02 -0.52 -4.95 118.68 123.62 2k39 s LEU 67 Ca -0.02 0.35 0.07 0.00 0.02 0.00 0.00 54.13 54.55 2k39 s LEU 67 Cb -0.14 -3.10 -0.06 0.00 0.02 0.00 0.00 46.19 42.91 2k39 s LEU 67 CO 0.02 -0.00 -0.08 -1.00 0.02 0.00 0.00 176.35 175.31 2k39 s HIS 68 N -1.81 1.95 0.11 0.29 3.76 -0.44 -0.90 115.29 118.25 2k39 s HIS 68 Ca 0.37 -0.65 0.02 0.00 -0.15 0.00 0.00 55.06 54.66 2k39 s HIS 68 Cb -0.11 -1.07 -0.04 0.00 1.11 0.00 0.00 32.58 32.46 2k39 s HIS 68 CO 0.29 0.33 -0.07 -1.17 -0.85 0.00 0.00 174.74 173.26 2k39 s LEU 69 N -3.44 2.51 -0.01 0.89 2.96 -1.25 -1.68 118.68 118.67 2k39 s LEU 69 Ca 0.29 -1.01 -0.18 0.00 -0.22 0.00 0.00 54.13 53.00 2k39 s LEU 69 Cb 0.03 -0.14 0.03 0.00 0.50 0.00 0.00 46.19 46.61 2k39 s LEU 69 CO 0.11 -0.43 0.39 -0.69 -1.32 0.00 0.00 176.35 174.41 2k39 s VAL 70 N -3.55 0.05 0.11 1.68 1.01 -1.13 -4.77 120.40 113.80 2k39 s VAL 70 Ca 0.13 -0.40 0.04 0.00 0.00 0.00 0.00 61.98 61.76 2k39 s VAL 70 Cb 0.05 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 2k39 s VAL 70 CO -0.03 -0.22 0.06 -0.76 0.00 0.00 0.00 175.10 174.15 2k39 s LEU 71 N -1.40 3.64 0.20 3.92 1.43 -1.26 -0.94 118.68 124.27 2k39 s LEU 71 Ca -0.12 -0.12 -0.18 0.00 -1.03 0.00 0.00 54.13 52.68 2k39 s LEU 71 Cb -0.04 -2.33 0.18 0.00 0.03 0.00 0.00 46.19 44.03 2k39 s LEU 71 CO 0.04 0.15 1.60 -0.09 0.23 0.00 0.00 176.35 178.28 2k39 h ARG 72 N 3.12 -0.10 -3.68 1.70 2.43 -0.60 -3.42 114.38 113.83 2k39 h ARG 72 Ca -0.47 0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 58.53 2k39 h ARG 72 Cb 1.17 0.02 -0.22 0.00 -0.42 0.00 0.00 29.97 30.52 2k39 h ARG 72 CO 0.63 -0.07 -0.60 -0.48 -1.51 0.00 0.00 179.97 177.94 2k39 s LEU 73 N -10.79 1.83 -0.09 3.80 -0.00 -1.26 -5.05 118.68 107.12 2k39 s LEU 73 Ca -0.14 -0.21 0.08 0.00 -0.00 0.00 0.00 54.13 53.85 2k39 s LEU 73 Cb 0.18 0.37 -0.11 0.00 -0.00 0.00 0.00 46.19 46.62 2k39 s LEU 73 CO 0.71 -0.26 0.02 -1.14 -0.00 0.00 0.00 176.35 175.68 2k39 n ARG 74 N 1.92 2.26 0.00 1.48 0.63 -1.26 -5.04 116.66 116.65 2k39 n ARG 74 Ca -0.20 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.73 2k39 n ARG 74 Cb 0.56 -1.24 0.00 0.00 0.45 0.00 0.00 32.46 32.23 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 2.47 2.95 0.00 5.14 0.00 -1.26 -5.21 105.19 109.29 2k39 n GLY 75 Ca -0.16 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93