#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 3.97 0.31 2.12 0.00 -1.26 -0.44 119.66 124.35 2k39 s GLN 2 Ca 0.00 0.56 0.05 0.00 -0.00 0.00 0.00 55.36 55.97 2k39 s GLN 2 Cb 0.00 -3.72 -0.06 0.00 0.00 0.00 0.00 33.01 29.23 2k39 s GLN 2 CO 0.00 -0.64 0.00 0.96 0.00 0.00 0.00 175.29 175.61 2k39 s ILE 3 N 2.87 1.44 -0.11 3.63 -4.36 -0.46 -1.19 121.20 123.02 2k39 s ILE 3 Ca 0.31 -2.05 -0.04 0.00 -0.26 0.00 0.00 60.65 58.61 2k39 s ILE 3 Cb -0.14 -2.64 0.05 0.00 1.25 0.00 0.00 42.46 40.98 2k39 s ILE 3 CO 0.12 -0.15 0.09 -0.36 0.24 0.00 0.00 174.94 174.88 2k39 s PHE 4 N -3.13 0.07 -0.41 1.37 0.08 -0.74 -1.26 117.98 113.96 2k39 s PHE 4 Ca 0.33 0.05 -0.14 0.00 0.12 0.00 0.00 56.93 57.29 2k39 s PHE 4 Cb 0.07 -0.54 0.03 0.00 -0.57 0.00 0.00 43.02 42.00 2k39 s PHE 4 CO 0.14 -0.36 0.28 0.08 -0.10 0.00 0.00 175.22 175.26 2k39 s VAL 5 N 2.18 5.02 -0.25 -0.44 1.01 -0.95 -1.43 120.40 125.54 2k39 s VAL 5 Ca 0.04 -0.80 -0.16 0.00 0.00 0.00 0.00 61.98 61.05 2k39 s VAL 5 Cb -0.14 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.37 2k39 s VAL 5 CO -0.06 -0.33 0.44 -0.75 0.00 0.00 0.00 175.10 174.39 2k39 s LYS 6 N 1.63 4.07 1.15 2.72 2.20 -0.58 -2.14 119.74 128.78 2k39 s LYS 6 Ca 0.04 0.19 -0.19 0.00 -0.36 0.00 0.00 55.97 55.65 2k39 s LYS 6 Cb -0.20 -3.63 0.27 0.00 -1.51 0.00 0.00 37.83 32.77 2k39 s LYS 6 CO 0.08 -0.26 1.20 0.95 -0.36 0.00 0.00 175.35 176.96 2k39 s THR 7 N 2.01 1.70 0.18 3.43 -4.23 -0.76 -3.33 115.64 114.64 2k39 s THR 7 Ca 0.18 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.74 2k39 s THR 7 Cb -0.16 -2.67 -0.13 0.00 1.34 0.00 0.00 72.50 70.88 2k39 s THR 7 CO 0.09 0.00 1.42 -0.07 -0.54 0.00 0.00 174.62 175.52 2k39 h LEU 8 N -2.36 0.20 -0.79 4.79 -0.00 -1.89 -3.02 115.31 112.25 2k39 h LEU 8 Ca -0.43 -0.16 -0.03 0.00 -0.00 0.00 0.00 57.88 57.27 2k39 h LEU 8 Cb 1.26 -0.06 -0.00 0.00 -0.00 0.00 0.00 40.66 41.86 2k39 h LEU 8 CO 0.31 0.94 -0.12 0.71 -0.00 0.00 0.00 178.44 180.27 2k39 h THR 9 N 0.09 0.26 0.00 0.22 1.35 -2.00 -3.47 112.91 109.36 2k39 h THR 9 Ca -0.03 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 2k39 h THR 9 Cb 1.43 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 69.68 2k39 h THR 9 CO 0.12 0.12 0.00 0.61 -0.25 0.00 0.00 175.52 176.12 2k39 n GLY 10 N 0.50 0.34 3.77 5.82 0.00 -1.14 -5.07 105.19 109.40 2k39 n GLY 10 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.96 3.82 -0.30 1.61 2.20 -1.26 -4.73 119.74 120.12 2k39 s LYS 11 Ca 0.00 2.09 -0.03 0.00 -0.36 0.00 0.00 55.97 57.66 2k39 s LYS 11 Cb 0.00 -2.62 0.10 0.00 -1.51 0.00 0.00 37.83 33.80 2k39 s LYS 11 CO 0.00 -0.60 0.12 0.99 -0.36 0.00 0.00 175.35 175.51 2k39 s THR 12 N -1.32 0.15 -0.14 3.43 2.01 -1.26 -1.82 115.64 116.68 2k39 s THR 12 Ca 0.60 -0.91 -0.14 0.00 0.31 0.00 0.00 61.69 61.55 2k39 s THR 12 Cb -0.36 -1.14 -0.05 0.00 0.01 0.00 0.00 72.50 70.96 2k39 s THR 12 CO 0.46 -0.72 0.31 -0.63 -0.69 0.00 0.00 174.62 173.35 2k39 s ILE 13 N 1.98 5.28 -0.50 1.82 -1.09 -0.91 -4.86 121.20 122.92 2k39 s ILE 13 Ca 0.09 0.59 -0.19 0.00 -2.23 0.00 0.00 60.65 58.92 2k39 s ILE 13 Cb -0.16 -3.64 0.06 0.00 -1.58 0.00 0.00 42.46 37.13 2k39 s ILE 13 CO -0.34 0.42 0.60 -0.89 -1.23 0.00 0.00 174.94 173.50 2k39 s THR 14 N 0.22 4.91 -0.17 2.92 2.01 -1.26 -2.24 115.64 122.03 2k39 s THR 14 Ca 0.18 -0.54 -0.16 0.00 0.31 0.00 0.00 61.69 61.48 2k39 s THR 14 Cb -0.13 -4.28 -0.04 0.00 0.01 0.00 0.00 72.50 68.05 2k39 s THR 14 CO 0.05 -0.78 0.40 -0.76 -0.69 0.00 0.00 174.62 172.84 2k39 s LEU 15 N 2.54 4.20 -0.42 4.42 1.43 -0.39 -4.94 118.68 125.51 2k39 s LEU 15 Ca 0.14 0.59 -0.18 0.00 -1.03 0.00 0.00 54.13 53.65 2k39 s LEU 15 Cb -0.20 -2.54 0.02 0.00 0.03 0.00 0.00 46.19 43.50 2k39 s LEU 15 CO 0.11 -0.03 0.47 -0.70 0.23 0.00 0.00 176.35 176.43 2k39 s GLU 16 N 1.01 3.17 0.42 1.70 -6.30 -1.26 -1.36 118.70 116.08 2k39 s GLU 16 Ca 0.20 -0.65 0.07 0.00 -2.50 0.00 0.00 54.97 52.09 2k39 s GLU 16 Cb -0.14 -3.95 -0.06 0.00 0.00 0.00 0.00 34.13 29.98 2k39 s GLU 16 CO 0.08 -0.86 0.12 0.14 0.02 0.00 0.00 175.26 174.76 2k39 s VAL 17 N 2.26 2.14 0.30 3.70 -7.23 0.41 -4.84 120.40 117.14 2k39 s VAL 17 Ca 0.14 -1.81 0.09 0.00 -1.81 0.00 0.00 61.98 58.60 2k39 s VAL 17 Cb -0.16 -2.94 -0.05 0.00 0.56 0.00 0.00 36.38 33.79 2k39 s VAL 17 CO 0.14 0.00 0.01 -1.61 -0.31 0.00 0.00 175.10 173.33 2k39 s GLU 18 N -3.85 2.18 0.31 4.82 2.02 -1.26 0.70 118.70 123.62 2k39 s GLU 18 Ca 0.37 -1.58 0.19 0.00 0.02 0.00 0.00 54.97 53.97 2k39 s GLU 18 Cb 0.06 -2.05 1.01 0.00 0.10 0.00 0.00 34.13 33.25 2k39 s GLU 18 CO 0.20 0.24 1.54 -0.35 0.02 0.00 0.00 175.26 176.92 2k39 n PRO 19 N -0.93 0.12 -0.01 0.39 -0.04 -1.26 -2.26 135.00 131.01 2k39 n PRO 19 Ca -0.05 0.61 0.14 0.00 -0.04 0.00 0.00 63.50 64.16 2k39 n PRO 19 Cb 0.61 -1.98 0.48 0.00 -0.04 0.00 0.00 33.50 32.57 2k39 n PRO 19 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2k39 n SER 20 N -2.17 1.63 -4.75 3.54 3.41 -1.26 -2.36 113.62 111.65 2k39 n SER 20 Ca -0.01 -1.55 -0.41 0.00 -0.26 0.00 0.00 58.87 56.64 2k39 n SER 20 Cb 0.11 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.01 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 -1.97 7.19 0.76 4.04 1.11 -0.96 -4.84 116.67 122.00 2k39 s ASP 21 Ca 0.37 2.25 -0.09 0.00 0.18 0.00 0.00 52.55 55.26 2k39 s ASP 21 Cb 0.21 -2.62 0.08 0.00 1.07 0.00 0.00 42.92 41.66 2k39 s ASP 21 CO 0.33 -0.24 1.09 0.42 1.18 0.00 0.00 175.17 177.95 2k39 s THR 22 N -0.70 2.16 0.21 -1.27 -4.23 -1.26 -2.86 115.64 107.70 2k39 s THR 22 Ca 0.48 -0.17 -0.09 0.00 -1.18 0.00 0.00 61.69 60.73 2k39 s THR 22 Cb -0.32 -2.99 0.16 0.00 1.34 0.00 0.00 72.50 70.69 2k39 s THR 22 CO 0.39 0.00 1.86 0.40 -0.54 0.00 0.00 174.62 176.73 2k39 h ILE 23 N -0.82 1.11 -0.67 2.99 2.04 -1.83 0.19 117.51 120.52 2k39 h ILE 23 Ca -0.45 -0.32 0.14 0.00 1.00 0.00 0.00 64.86 65.24 2k39 h ILE 23 Cb 1.31 0.11 -0.10 0.00 -0.74 0.00 0.00 36.82 37.40 2k39 h ILE 23 CO 0.60 0.17 0.09 -0.08 0.00 0.00 0.00 178.15 178.93 2k39 h GLU 24 N 0.92 0.19 -0.06 2.37 4.57 -1.95 0.20 114.58 120.82 2k39 h GLU 24 Ca 0.30 -0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.37 2k39 h GLU 24 Cb 0.01 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.56 2k39 h GLU 24 CO -0.11 0.13 -0.35 -0.91 -1.18 0.00 0.00 179.01 176.59 2k39 h ASN 25 N 0.20 0.42 -0.40 1.04 -0.26 -1.49 -1.06 115.58 114.03 2k39 h ASN 25 Ca 0.36 -0.66 0.07 0.00 -0.56 0.00 0.00 56.30 55.51 2k39 h ASN 25 Cb 0.60 -0.12 -0.06 0.00 -1.06 0.00 0.00 38.32 37.67 2k39 h ASN 25 CO -0.51 1.01 0.00 0.58 -1.06 0.00 0.00 177.43 177.45 2k39 h VAL 26 N -0.15 0.70 -0.34 2.81 2.07 -0.67 -0.21 116.25 120.46 2k39 h VAL 26 Ca -0.03 -0.04 -0.10 0.00 0.82 0.00 0.00 66.70 67.35 2k39 h VAL 26 Cb 1.01 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 2k39 h VAL 26 CO 0.07 0.02 -0.22 0.11 0.02 0.00 0.00 177.57 177.57 2k39 h LYS 27 N 0.11 0.65 -0.98 1.57 1.57 -0.51 -0.63 116.57 118.36 2k39 h LYS 27 Ca 0.20 -0.25 0.06 0.00 -1.87 0.00 0.00 60.65 58.79 2k39 h LYS 27 Cb 0.28 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.49 2k39 h LYS 27 CO -0.33 0.82 0.63 0.00 -0.57 0.00 0.00 179.45 180.00 2k39 h ALA 28 N 1.18 1.34 -0.02 3.86 0.00 -0.76 -2.18 119.26 122.68 2k39 h ALA 28 Ca 0.08 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2k39 h ALA 28 Cb 0.69 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2k39 h ALA 28 CO 0.05 0.43 0.01 0.87 0.00 0.00 0.00 179.25 180.62 2k39 h LYS 29 N 1.16 0.03 -0.64 0.00 1.57 0.44 -0.33 116.57 118.79 2k39 h LYS 29 Ca 0.42 -0.00 0.11 0.00 -1.87 0.00 0.00 60.65 59.30 2k39 h LYS 29 Cb 0.14 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 2k39 h LYS 29 CO -0.16 0.13 0.43 0.82 -0.57 0.00 0.00 179.45 180.10 2k39 h ILE 30 N -0.07 0.88 -0.03 1.86 2.04 -1.24 -2.79 117.51 118.15 2k39 h ILE 30 Ca 0.01 -0.15 -0.24 0.00 1.00 0.00 0.00 64.86 65.48 2k39 h ILE 30 Cb 0.11 0.41 0.01 0.00 -0.74 0.00 0.00 36.82 36.61 2k39 h ILE 30 CO -0.00 0.08 -0.94 -0.61 0.00 0.00 0.00 178.15 176.68 2k39 h GLN 31 N 0.43 0.58 -0.90 2.37 4.15 -0.67 -2.67 115.11 118.40 2k39 h GLN 31 Ca 0.30 -0.58 0.11 0.00 0.77 0.00 0.00 58.65 59.25 2k39 h GLN 31 Cb 0.60 0.16 -0.07 0.00 0.21 0.00 0.00 27.48 28.38 2k39 h GLN 31 CO -0.09 1.20 0.58 0.22 -1.93 0.00 0.00 178.83 178.81 2k39 h ASP 32 N 0.34 0.77 0.00 -0.69 3.58 -0.93 -1.99 116.42 117.51 2k39 h ASP 32 Ca -0.09 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.39 2k39 h ASP 32 Cb 1.58 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 42.50 2k39 h ASP 32 CO 0.18 0.43 0.00 0.29 -2.88 0.00 0.00 179.24 177.25 2k39 n LYS 33 N -4.55 0.00 0.00 0.28 4.01 -1.07 -4.67 118.16 112.16 2k39 n LYS 33 Ca 0.16 0.00 0.13 0.00 -0.51 0.00 0.00 58.31 58.10 2k39 n LYS 33 Cb 0.36 -0.33 0.42 0.00 -0.51 0.00 0.00 35.03 34.97 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2k39 n GLU 34 N -0.38 1.77 -0.89 1.97 -0.58 -1.01 -4.95 120.64 116.58 2k39 n GLU 34 Ca 0.00 -1.16 0.00 0.00 -0.42 0.00 0.00 57.16 55.58 2k39 n GLU 34 Cb 0.00 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.39 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 1.22 0.54 3.70 0.62 0.00 -0.75 -5.02 105.19 105.51 2k39 n GLY 35 Ca 0.17 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.00 3.29 0.59 -0.61 -1.09 -1.26 -4.94 121.20 115.18 2k39 s ILE 36 Ca 0.00 0.80 -0.19 0.00 -2.23 0.00 0.00 60.65 59.02 2k39 s ILE 36 Cb 0.00 -3.51 -0.04 0.00 -1.58 0.00 0.00 42.46 37.33 2k39 s ILE 36 CO 0.00 0.02 1.24 -2.16 -1.23 0.00 0.00 174.94 172.81 2k39 s PRO 37 N 2.03 2.97 -0.01 2.79 0.04 -1.26 -3.89 135.00 137.67 2k39 s PRO 37 Ca 0.68 1.91 -0.24 0.00 0.04 0.00 0.00 61.00 63.39 2k39 s PRO 37 Cb -0.37 -1.98 -0.15 0.00 0.04 0.00 0.00 34.50 32.04 2k39 s PRO 37 CO 0.30 -1.23 1.09 -1.00 0.04 0.00 0.00 177.00 176.19 2k39 h PRO 38 N 0.96 -0.43 -0.39 0.56 0.13 -1.96 -3.32 132.00 127.54 2k39 h PRO 38 Ca -0.51 0.03 0.11 0.00 -0.87 0.00 0.00 66.00 64.77 2k39 h PRO 38 Cb 1.30 0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.52 2k39 h PRO 38 CO 0.55 -0.11 0.46 -0.44 -0.23 0.00 0.00 178.00 178.24 2k39 h ASP 39 N -0.87 0.00 1.05 1.44 3.32 -1.96 -0.92 116.42 118.48 2k39 h ASP 39 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2k39 h ASP 39 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 2k39 h ASP 39 CO 0.08 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.60 2k39 n GLN 40 N -3.61 0.05 -4.22 3.56 1.13 -1.25 -4.70 117.38 108.34 2k39 n GLN 40 Ca 0.07 0.06 -0.28 0.00 -1.94 0.00 0.00 57.00 54.91 2k39 n GLN 40 Cb 0.63 -1.56 -0.09 0.00 0.11 0.00 0.00 30.24 29.34 2k39 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2k39 s GLN 41 N -3.02 2.28 -0.01 -1.09 -1.52 -0.35 -0.26 119.66 115.69 2k39 s GLN 41 Ca 0.13 -1.09 0.01 0.00 -1.95 0.00 0.00 55.36 52.46 2k39 s GLN 41 Cb 0.17 -2.32 0.00 0.00 -0.22 0.00 0.00 33.01 30.64 2k39 s GLN 41 CO 0.52 0.47 -0.02 0.50 -0.25 0.00 0.00 175.29 176.51 2k39 s ARG 42 N -2.67 0.22 0.06 2.91 3.52 -0.56 -4.76 118.95 117.68 2k39 s ARG 42 Ca 0.25 -0.07 0.03 0.00 -0.13 0.00 0.00 55.73 55.81 2k39 s ARG 42 Cb -0.10 -0.24 -0.04 0.00 -1.56 0.00 0.00 34.95 33.01 2k39 s ARG 42 CO 0.17 0.03 0.02 -0.51 -0.81 0.00 0.00 175.30 174.20 2k39 s LEU 43 N 0.08 3.57 -0.15 -0.88 1.43 -1.26 -1.28 118.68 120.18 2k39 s LEU 43 Ca -0.00 -0.08 -0.05 0.00 -1.03 0.00 0.00 54.13 52.96 2k39 s LEU 43 Cb -0.03 -2.22 0.07 0.00 0.03 0.00 0.00 46.19 44.05 2k39 s LEU 43 CO -0.00 0.20 0.29 -0.63 0.23 0.00 0.00 176.35 176.44 2k39 s ILE 44 N -1.27 -0.45 -0.08 -0.59 1.01 -1.11 -0.70 121.20 118.01 2k39 s ILE 44 Ca 0.25 0.22 -0.08 0.00 0.00 0.00 0.00 60.65 61.03 2k39 s ILE 44 Cb -0.12 -0.51 0.02 0.00 0.01 0.00 0.00 42.46 41.86 2k39 s ILE 44 CO 0.17 0.07 0.23 0.12 0.00 0.00 0.00 174.94 175.54 2k39 s PHE 45 N 2.45 -0.24 -0.56 3.97 2.19 -0.99 -3.40 117.98 121.40 2k39 s PHE 45 Ca 0.02 0.59 0.00 0.00 0.33 0.00 0.00 56.93 57.87 2k39 s PHE 45 Cb -0.12 0.08 0.00 0.00 -1.31 0.00 0.00 43.02 41.67 2k39 s PHE 45 CO -0.10 -0.14 0.00 0.00 1.83 0.00 0.00 175.22 176.81 2k39 n ALA 46 N 2.84 -0.09 -0.21 11.12 0.00 -1.26 -3.07 120.51 129.84 2k39 n ALA 46 Ca -0.13 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2k39 n ALA 46 Cb 0.58 -0.90 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 -2.19 0.69 3.08 0.00 0.00 -1.26 -5.05 105.19 100.46 2k39 n GLY 47 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.79 1.60 0.11 1.61 -2.85 -1.17 -5.11 119.74 113.15 2k39 s LYS 48 Ca 0.00 -0.50 -0.30 0.00 -1.00 0.00 0.00 55.97 54.17 2k39 s LYS 48 Cb 0.00 -1.38 -0.06 0.00 -2.06 0.00 0.00 37.83 34.32 2k39 s LYS 48 CO 0.00 0.16 1.14 -0.65 0.10 0.00 0.00 175.35 176.09 2k39 s GLN 49 N 0.24 4.52 0.09 1.78 -0.21 -1.26 -2.34 119.66 122.47 2k39 s GLN 49 Ca -0.07 1.72 -0.23 0.00 0.02 0.00 0.00 55.36 56.80 2k39 s GLN 49 Cb -0.12 -3.32 -0.07 0.00 1.00 0.00 0.00 33.01 30.50 2k39 s GLN 49 CO 0.02 -0.09 0.69 -0.51 -2.12 0.00 0.00 175.29 173.29 2k39 s LEU 50 N 0.37 4.52 0.06 2.90 1.43 0.13 -4.98 118.68 123.10 2k39 s LEU 50 Ca 0.54 1.43 0.05 0.00 -1.03 0.00 0.00 54.13 55.12 2k39 s LEU 50 Cb -0.29 -3.12 -0.04 0.00 0.03 0.00 0.00 46.19 42.77 2k39 s LEU 50 CO 0.32 0.16 -0.08 -1.61 0.23 0.00 0.00 176.35 175.37 2k39 s GLU 51 N -0.73 2.34 0.35 1.70 0.41 -1.26 -4.51 118.70 117.00 2k39 s GLU 51 Ca 0.34 -0.88 -0.28 0.00 -0.41 0.00 0.00 54.97 53.73 2k39 s GLU 51 Cb -0.21 -2.40 -0.11 0.00 -1.78 0.00 0.00 34.13 29.63 2k39 s GLU 51 CO 0.22 0.55 1.39 -0.51 -0.49 0.00 0.00 175.26 176.42 2k39 s ASP 52 N -1.86 6.58 0.00 -0.19 1.01 -1.26 -4.14 116.67 116.81 2k39 s ASP 52 Ca 0.20 2.85 0.00 0.00 0.71 0.00 0.00 52.55 56.31 2k39 s ASP 52 Cb -0.11 -2.66 0.00 0.00 1.01 0.00 0.00 42.92 41.16 2k39 s ASP 52 CO 0.11 -0.69 0.00 0.61 0.21 0.00 0.00 175.17 175.41 2k39 n GLY 53 N 0.71 1.24 3.12 0.21 0.00 -1.26 -5.09 105.19 104.11 2k39 n GLY 53 Ca 0.01 0.00 -0.18 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 -0.06 0.77 0.22 1.61 0.52 -1.26 -5.03 118.95 115.72 2k39 s ARG 54 Ca 0.00 -0.77 -0.02 0.00 -0.52 0.00 0.00 55.73 54.42 2k39 s ARG 54 Cb 0.00 -0.73 -0.05 0.00 0.52 0.00 0.00 34.95 34.70 2k39 s ARG 54 CO 0.00 0.17 0.43 0.95 0.02 0.00 0.00 175.30 176.87 2k39 s THR 55 N -1.02 5.15 0.45 0.02 -4.23 -1.26 -2.17 115.64 112.59 2k39 s THR 55 Ca -0.02 -0.21 0.22 0.00 -1.18 0.00 0.00 61.69 60.50 2k39 s THR 55 Cb -0.08 -3.72 0.41 0.00 1.34 0.00 0.00 72.50 70.45 2k39 s THR 55 CO 0.01 -0.19 1.86 -0.07 -0.54 0.00 0.00 174.62 175.69 2k39 h LEU 56 N 2.01 0.29 -0.04 4.79 3.38 -1.52 0.12 115.31 124.34 2k39 h LEU 56 Ca -0.48 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2k39 h LEU 56 Cb 1.19 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2k39 h LEU 56 CO 0.68 0.11 0.00 -0.24 0.09 0.00 0.00 178.44 179.08 2k39 n SER 57 N -4.45 0.08 0.11 -0.43 2.88 -1.00 0.10 113.62 110.92 2k39 n SER 57 Ca 0.20 0.51 -0.01 0.00 -1.33 0.00 0.00 58.87 58.23 2k39 n SER 57 Cb 0.79 -0.53 0.03 0.00 -0.75 0.00 0.00 64.21 63.75 2k39 n SER 57 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2k39 h ASP 58 N 0.00 0.00 -0.02 -3.46 1.82 -1.05 -3.00 116.42 110.71 2k39 h ASP 58 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2k39 h ASP 58 Cb 0.41 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.42 2k39 h ASP 58 CO 0.00 0.70 -0.00 -1.22 -1.61 0.00 0.00 179.24 177.11 2k39 n TYR 59 N -3.40 0.00 -3.62 0.28 4.01 -1.15 -5.00 117.16 108.27 2k39 n TYR 59 Ca 0.00 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.50 2k39 n TYR 59 Cb 0.77 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.87 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 1.01 -6.19 -4.61 7.72 6.94 -0.04 -4.95 115.26 115.14 2k39 n ASN 60 Ca 0.11 -0.56 -0.43 0.00 -0.02 0.00 0.00 54.58 53.67 2k39 n ASN 60 Cb 0.45 -4.88 -0.02 0.00 -2.36 0.00 0.00 39.78 32.97 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 -3.31 3.67 0.01 1.53 1.01 0.12 -4.95 121.20 119.27 2k39 s ILE 61 Ca 0.59 0.72 0.00 0.00 0.00 0.00 0.00 60.65 61.96 2k39 s ILE 61 Cb -0.27 -3.80 0.00 0.00 0.01 0.00 0.00 42.46 38.41 2k39 s ILE 61 CO 0.73 -0.44 0.00 0.00 0.00 0.00 0.00 174.94 175.24 2k39 n GLN 62 N 8.02 1.61 -1.70 2.79 6.02 -1.26 -4.46 117.38 128.39 2k39 n GLN 62 Ca 0.20 -0.04 -0.54 0.00 -0.01 0.00 0.00 57.00 56.60 2k39 n GLN 62 Cb 0.46 0.01 -0.06 0.00 1.02 0.00 0.00 30.24 31.67 2k39 n GLN 62 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2k39 n LYS 63 N -0.40 1.54 -2.75 -1.09 2.85 -1.26 -3.44 118.16 113.61 2k39 n LYS 63 Ca -0.00 0.56 -0.10 0.00 -1.05 0.00 0.00 58.31 57.72 2k39 n LYS 63 Cb 0.01 -2.31 0.05 0.00 -0.65 0.00 0.00 35.03 32.13 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 5.84 -2.94 -4.37 -1.58 2.13 -0.33 -5.02 120.64 114.37 2k39 n GLU 64 Ca 0.25 0.52 -0.34 0.00 0.66 0.00 0.00 57.16 58.25 2k39 n GLU 64 Cb 0.19 -4.39 -0.09 0.00 0.27 0.00 0.00 31.44 27.42 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 -3.59 5.16 0.01 4.31 0.01 -1.22 -5.04 113.70 113.34 2k39 s SER 65 Ca 0.12 0.09 0.02 0.00 1.31 0.00 0.00 55.95 57.49 2k39 s SER 65 Cb -0.02 -1.41 -0.04 0.00 0.21 0.00 0.00 66.02 64.77 2k39 s SER 65 CO 0.45 0.35 -0.02 -0.89 0.41 0.00 0.00 173.24 173.54 2k39 s THR 66 N -0.94 3.98 0.33 1.44 2.01 -1.26 -1.79 115.64 119.42 2k39 s THR 66 Ca 0.15 -0.69 0.04 0.00 0.31 0.00 0.00 61.69 61.50 2k39 s THR 66 Cb -0.11 -2.77 -0.01 0.00 0.01 0.00 0.00 72.50 69.61 2k39 s THR 66 CO 0.04 0.36 0.14 0.00 -0.69 0.00 0.00 174.62 174.48 2k39 n LEU 67 N 1.38 0.00 0.00 4.42 -0.00 -0.51 -4.97 117.00 117.32 2k39 n LEU 67 Ca -0.15 -2.63 -0.13 0.00 -0.00 0.00 0.00 56.01 53.10 2k39 n LEU 67 Cb 0.53 0.95 -0.02 0.00 -0.00 0.00 0.00 43.42 44.88 2k39 n LEU 67 CO 0.33 -0.41 0.26 0.00 -0.00 0.00 0.00 177.39 177.57 2k39 n HIS 68 N -0.73 -1.69 -4.04 1.47 1.44 -1.22 -1.53 115.22 108.92 2k39 n HIS 68 Ca -0.03 -2.20 -0.10 0.00 -2.01 0.00 0.00 57.72 53.38 2k39 n HIS 68 Cb 0.51 0.65 -0.07 0.00 0.12 0.00 0.00 29.99 31.20 2k39 n HIS 68 CO 0.00 0.00 0.00 -0.48 -2.81 0.00 0.00 176.34 173.05 2k39 s LEU 69 N 0.00 0.76 -0.05 2.39 0.05 -1.21 -2.75 118.68 117.87 2k39 s LEU 69 Ca 0.25 -1.04 0.03 0.00 0.05 0.00 0.00 54.13 53.42 2k39 s LEU 69 Cb -0.02 1.19 0.00 0.00 -2.05 0.00 0.00 46.19 45.32 2k39 s LEU 69 CO 0.18 -0.98 -0.13 0.54 -0.55 0.00 0.00 176.35 175.42 2k39 s VAL 70 N -4.04 1.14 0.20 1.48 0.11 -0.40 -4.76 120.40 114.12 2k39 s VAL 70 Ca 0.25 -0.53 -0.31 0.00 -2.93 0.00 0.00 61.98 58.46 2k39 s VAL 70 Cb 0.03 -1.01 -0.16 0.00 -1.53 0.00 0.00 36.38 33.71 2k39 s VAL 70 CO 0.07 0.34 1.01 0.00 -3.33 0.00 0.00 175.10 173.20 2k39 n LEU 71 N 3.44 1.08 -4.15 2.54 -0.00 -1.26 -1.50 117.00 117.15 2k39 n LEU 71 Ca -0.20 1.15 -0.30 0.00 -0.00 0.00 0.00 56.01 56.66 2k39 n LEU 71 Cb 0.53 -1.18 -0.17 0.00 -0.00 0.00 0.00 43.42 42.60 2k39 n LEU 71 CO 0.25 -1.63 -0.53 -0.60 -0.00 0.00 0.00 177.39 174.88 2k39 s ARG 72 N -0.78 2.62 -0.06 1.47 3.52 0.64 -4.87 118.95 121.49 2k39 s ARG 72 Ca 0.69 -0.73 0.18 0.00 -0.13 0.00 0.00 55.73 55.74 2k39 s ARG 72 Cb -0.85 -2.03 -0.23 0.00 -1.56 0.00 0.00 34.95 30.29 2k39 s ARG 72 CO 0.55 0.12 0.47 1.28 -0.81 0.00 0.00 175.30 176.90 2k39 n LEU 73 N 3.66 0.36 -4.86 -0.88 4.77 -1.26 -4.51 117.00 114.28 2k39 n LEU 73 Ca -0.20 0.16 -0.37 0.00 -0.03 0.00 0.00 56.01 55.57 2k39 n LEU 73 Cb 0.52 0.22 -0.06 0.00 -2.33 0.00 0.00 43.42 41.77 2k39 n LEU 73 CO 0.27 0.26 -0.06 -0.60 -1.33 0.00 0.00 177.39 175.93 2k39 s ARG 74 N -2.88 3.63 -0.06 3.23 3.52 -1.26 -5.10 118.95 120.03 2k39 s ARG 74 Ca -0.07 0.08 -0.00 0.00 -0.13 0.00 0.00 55.73 55.61 2k39 s ARG 74 Cb 0.09 -3.20 0.03 0.00 -1.56 0.00 0.00 34.95 30.30 2k39 s ARG 74 CO 0.84 0.74 -0.02 0.20 -0.81 0.00 0.00 175.30 176.25 2k39 s GLY 75 N -1.06 0.48 0.00 8.12 0.00 -1.26 -4.74 107.32 108.86 2k39 s GLY 75 Ca 0.19 -0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.79 2k39 s GLY 75 CO 0.08 0.82 0.00 0.61 0.00 0.00 0.00 173.10 174.61