#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 2.95 -0.09 2.12 -0.21 -1.26 -1.20 119.66 121.96 2k39 s GLN 2 Ca 0.00 -0.85 0.02 0.00 0.02 0.00 0.00 55.36 54.55 2k39 s GLN 2 Cb 0.00 -2.67 -0.02 0.00 1.00 0.00 0.00 33.01 31.32 2k39 s GLN 2 CO 0.00 -0.24 -0.15 0.96 -2.12 0.00 0.00 175.29 173.75 2k39 s ILE 3 N -2.43 2.96 -0.41 1.08 -4.36 -0.67 -1.83 121.20 115.54 2k39 s ILE 3 Ca 0.50 -0.72 -0.24 0.00 -0.26 0.00 0.00 60.65 59.93 2k39 s ILE 3 Cb -0.10 -2.20 0.02 0.00 1.25 0.00 0.00 42.46 41.43 2k39 s ILE 3 CO 0.35 0.56 0.82 -0.36 0.24 0.00 0.00 174.94 176.54 2k39 s PHE 4 N -0.13 3.03 -0.29 1.37 0.40 -0.21 -2.54 117.98 119.62 2k39 s PHE 4 Ca -0.02 0.40 -0.09 0.00 -0.60 0.00 0.00 56.93 56.62 2k39 s PHE 4 Cb -0.14 -3.62 -0.02 0.00 0.51 0.00 0.00 43.02 39.76 2k39 s PHE 4 CO 0.04 -0.90 0.13 0.08 0.70 0.00 0.00 175.22 175.27 2k39 s VAL 5 N 3.31 4.58 0.16 -0.44 1.01 0.15 -0.68 120.40 128.50 2k39 s VAL 5 Ca 0.32 -0.28 0.11 0.00 0.00 0.00 0.00 61.98 62.13 2k39 s VAL 5 Cb -0.12 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2k39 s VAL 5 CO 0.21 0.17 -0.24 -0.54 0.00 0.00 0.00 175.10 174.70 2k39 s LYS 6 N 1.63 1.53 0.27 2.72 1.02 -0.23 -0.27 119.74 126.42 2k39 s LYS 6 Ca 0.05 -1.41 -0.16 0.00 0.02 0.00 0.00 55.97 54.47 2k39 s LYS 6 Cb -0.16 -1.91 0.01 0.00 -0.52 0.00 0.00 37.83 35.24 2k39 s LYS 6 CO 0.06 0.43 0.59 -0.08 -0.92 0.00 0.00 175.35 175.43 2k39 s THR 7 N -1.40 0.00 -0.17 2.17 -1.32 -1.15 -0.32 115.64 113.45 2k39 s THR 7 Ca 0.18 -1.23 0.19 0.00 -1.21 0.00 0.00 61.69 59.63 2k39 s THR 7 Cb -0.09 -2.16 0.18 0.00 -1.51 0.00 0.00 72.50 68.92 2k39 s THR 7 CO 0.09 0.00 1.58 -0.07 -2.21 0.00 0.00 174.62 174.01 2k39 h LEU 8 N 2.13 0.00 0.00 9.08 -0.00 -1.91 -2.66 115.31 121.95 2k39 h LEU 8 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.65 2k39 h LEU 8 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.91 2k39 h LEU 8 CO 0.30 0.30 0.00 0.35 -0.00 0.00 0.00 178.44 179.40 2k39 n THR 9 N -3.22 0.25 0.00 0.22 -2.24 -1.26 -4.94 114.28 103.08 2k39 n THR 9 Ca 0.02 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 2k39 n THR 9 Cb 0.61 -0.65 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 2k39 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k39 n GLY 10 N 0.91 1.58 3.73 3.38 0.00 -1.00 -5.10 105.19 108.69 2k39 n GLY 10 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2k39 n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k39 n LYS 11 N 0.00 2.71 -3.80 1.61 4.01 -1.26 -4.84 118.16 116.60 2k39 n LYS 11 Ca 0.00 0.97 -0.36 0.00 -0.51 0.00 0.00 58.31 58.41 2k39 n LYS 11 Cb 0.00 -2.78 -0.12 0.00 -0.51 0.00 0.00 35.03 31.62 2k39 n LYS 11 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 2k39 s THR 12 N 0.46 3.31 -0.34 -0.18 2.01 -1.26 -2.96 115.64 116.68 2k39 s THR 12 Ca 0.69 -1.77 -0.15 0.00 0.31 0.00 0.00 61.69 60.76 2k39 s THR 12 Cb -0.51 -3.13 -0.01 0.00 0.01 0.00 0.00 72.50 68.86 2k39 s THR 12 CO 0.42 -0.49 0.37 -0.63 -0.69 0.00 0.00 174.62 173.61 2k39 s ILE 13 N 1.21 5.16 -0.45 1.82 1.01 0.63 -4.92 121.20 125.65 2k39 s ILE 13 Ca 0.04 0.07 -0.22 0.00 0.00 0.00 0.00 60.65 60.54 2k39 s ILE 13 Cb -0.22 -3.83 0.03 0.00 0.01 0.00 0.00 42.46 38.44 2k39 s ILE 13 CO -0.02 -0.10 0.74 0.42 0.00 0.00 0.00 174.94 175.97 2k39 s THR 14 N 2.05 4.71 -0.06 2.92 -4.23 -1.26 -0.67 115.64 119.10 2k39 s THR 14 Ca 0.12 0.31 0.02 0.00 -1.18 0.00 0.00 61.69 60.97 2k39 s THR 14 Cb -0.16 -4.29 -0.03 0.00 1.34 0.00 0.00 72.50 69.36 2k39 s THR 14 CO 0.12 -0.68 -0.10 -0.76 -0.54 0.00 0.00 174.62 172.65 2k39 s LEU 15 N 3.13 2.96 0.01 4.79 1.43 -1.05 -4.99 118.68 124.97 2k39 s LEU 15 Ca 0.27 -0.11 -0.21 0.00 -1.03 0.00 0.00 54.13 53.06 2k39 s LEU 15 Cb -0.13 -1.63 -0.06 0.00 0.03 0.00 0.00 46.19 44.41 2k39 s LEU 15 CO 0.21 0.35 0.60 -1.61 0.23 0.00 0.00 176.35 176.14 2k39 s GLU 16 N -0.79 4.31 0.26 1.70 8.01 -1.26 -1.66 118.70 129.26 2k39 s GLU 16 Ca 0.12 0.76 0.01 0.00 0.01 0.00 0.00 54.97 55.86 2k39 s GLU 16 Cb -0.11 -3.33 -0.03 0.00 -4.31 0.00 0.00 34.13 26.35 2k39 s GLU 16 CO 0.01 0.41 0.23 0.14 0.01 0.00 0.00 175.26 176.06 2k39 s VAL 17 N -0.33 0.00 0.23 2.63 -7.23 -0.34 -4.98 120.40 110.37 2k39 s VAL 17 Ca 0.31 -1.92 0.02 0.00 -1.81 0.00 0.00 61.98 58.58 2k39 s VAL 17 Cb -0.19 -2.49 -0.05 0.00 0.56 0.00 0.00 36.38 34.21 2k39 s VAL 17 CO 0.18 0.00 0.03 -1.61 -0.31 0.00 0.00 175.10 173.38 2k39 s GLU 18 N -3.84 1.31 0.57 4.82 0.41 -1.26 -4.76 118.70 115.94 2k39 s GLU 18 Ca 0.38 -1.67 0.07 0.00 -0.41 0.00 0.00 54.97 53.34 2k39 s GLU 18 Cb 0.04 -0.44 0.25 0.00 -1.78 0.00 0.00 34.13 32.21 2k39 s GLU 18 CO 0.17 -0.16 0.97 -2.30 -0.49 0.00 0.00 175.26 173.45 2k39 n PRO 19 N -0.39 0.02 0.05 0.39 -0.02 -1.26 -1.75 135.00 132.04 2k39 n PRO 19 Ca -0.04 0.86 0.10 0.00 -2.02 0.00 0.00 63.50 62.40 2k39 n PRO 19 Cb 0.64 -2.27 -0.07 0.00 -0.02 0.00 0.00 33.50 31.78 2k39 n PRO 19 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2k39 n SER 20 N -2.51 0.51 -4.77 2.55 3.41 -1.26 -3.01 113.62 108.55 2k39 n SER 20 Ca 0.07 0.20 -0.38 0.00 -0.26 0.00 0.00 58.87 58.50 2k39 n SER 20 Cb 1.04 1.03 -0.01 0.00 -0.26 0.00 0.00 64.21 66.01 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 -5.07 6.25 0.53 4.04 1.01 -0.72 -4.81 116.67 117.89 2k39 s ASP 21 Ca -0.04 2.38 -0.02 0.00 0.71 0.00 0.00 52.55 55.57 2k39 s ASP 21 Cb 0.11 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.44 2k39 s ASP 21 CO 0.84 -0.87 0.79 0.42 0.21 0.00 0.00 175.17 176.56 2k39 s THR 22 N -1.46 3.68 -0.07 -1.27 -4.23 -1.26 -2.41 115.64 108.62 2k39 s THR 22 Ca 0.61 -0.29 -0.27 0.00 -1.18 0.00 0.00 61.69 60.57 2k39 s THR 22 Cb -0.31 -3.41 -0.23 0.00 1.34 0.00 0.00 72.50 69.90 2k39 s THR 22 CO 0.38 -0.35 1.06 0.40 -0.54 0.00 0.00 174.62 175.57 2k39 h ILE 23 N 0.09 1.55 0.00 2.99 1.08 -1.74 -3.20 117.51 118.29 2k39 h ILE 23 Ca -0.45 -1.67 0.00 0.00 -0.39 0.00 0.00 64.86 62.35 2k39 h ILE 23 Cb 1.26 2.67 0.00 0.00 -3.07 0.00 0.00 36.82 37.68 2k39 h ILE 23 CO 0.58 0.44 0.04 -1.84 -0.69 0.00 0.00 178.15 176.67 2k39 n GLU 24 N -4.73 0.01 0.03 2.37 0.00 -1.26 -0.78 120.64 116.28 2k39 n GLU 24 Ca -0.09 0.47 -0.17 0.00 0.00 0.00 0.00 57.16 57.37 2k39 n GLU 24 Cb 0.36 -1.56 -0.07 0.00 0.00 0.00 0.00 31.44 30.17 2k39 n GLU 24 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.13 176.16 2k39 h ASN 25 N 0.00 0.81 0.20 -1.84 -0.73 -1.96 -3.27 115.58 108.79 2k39 h ASN 25 Ca 0.00 -0.60 -0.16 0.00 1.87 0.00 0.00 56.30 57.41 2k39 h ASN 25 Cb 0.07 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.41 2k39 h ASN 25 CO 0.00 1.40 -0.60 0.58 -0.37 0.00 0.00 177.43 178.43 2k39 h VAL 26 N 0.40 1.36 -0.27 2.57 2.07 -1.03 -0.90 116.25 120.44 2k39 h VAL 26 Ca -0.09 -1.93 -0.19 0.00 0.82 0.00 0.00 66.70 65.32 2k39 h VAL 26 Cb 1.55 1.92 0.00 0.00 -1.52 0.00 0.00 31.29 33.24 2k39 h VAL 26 CO 0.18 0.58 -0.57 0.11 0.02 0.00 0.00 177.57 177.89 2k39 h LYS 27 N 0.30 0.84 -0.75 1.57 1.57 -1.67 0.31 116.57 118.74 2k39 h LYS 27 Ca -0.01 -0.54 0.03 0.00 -1.87 0.00 0.00 60.65 58.26 2k39 h LYS 27 Cb 1.13 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.47 2k39 h LYS 27 CO 0.10 1.18 0.48 0.00 -0.57 0.00 0.00 179.45 180.64 2k39 h ALA 28 N 0.71 0.98 0.00 3.86 0.00 -1.58 -3.18 119.26 120.06 2k39 h ALA 28 Ca 0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2k39 h ALA 28 Cb 1.17 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2k39 h ALA 28 CO 0.12 0.28 -0.37 0.87 0.00 0.00 0.00 179.25 180.15 2k39 h LYS 29 N 0.93 0.00 -0.16 0.00 1.57 -0.90 -2.90 116.57 115.11 2k39 h LYS 29 Ca 0.30 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.12 2k39 h LYS 29 Cb 0.01 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.28 2k39 h LYS 29 CO -0.11 0.09 -0.08 0.82 -0.57 0.00 0.00 179.45 179.60 2k39 h ILE 30 N 0.00 0.74 0.00 1.86 2.04 -1.05 -3.23 117.51 117.87 2k39 h ILE 30 Ca -0.01 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.79 2k39 h ILE 30 Cb 1.09 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 2k39 h ILE 30 CO 0.01 0.00 -0.31 -0.61 0.00 0.00 0.00 178.15 177.24 2k39 h GLN 31 N -0.07 0.00 -0.60 2.37 4.15 -1.49 0.14 115.11 119.60 2k39 h GLN 31 Ca 0.09 0.00 0.11 0.00 0.77 0.00 0.00 58.65 59.62 2k39 h GLN 31 Cb 0.21 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 27.81 2k39 h GLN 31 CO -0.21 0.31 0.16 0.22 -1.93 0.00 0.00 178.83 177.39 2k39 h ASP 32 N 0.00 0.07 0.01 -0.69 3.58 -1.58 0.81 116.42 118.63 2k39 h ASP 32 Ca -0.00 0.10 -0.30 0.00 0.42 0.00 0.00 57.03 57.25 2k39 h ASP 32 Cb 0.61 0.12 -0.04 0.00 1.72 0.00 0.00 39.33 41.74 2k39 h ASP 32 CO 0.04 0.05 -1.62 0.29 -2.88 0.00 0.00 179.24 175.12 2k39 n LYS 33 N -5.09 0.59 -0.00 0.28 5.02 -1.00 -4.71 118.16 113.25 2k39 n LYS 33 Ca 0.09 0.47 0.06 0.00 -2.02 0.00 0.00 58.31 56.91 2k39 n LYS 33 Cb 0.31 -1.69 -0.09 0.00 -0.02 0.00 0.00 35.03 33.54 2k39 n LYS 33 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2k39 n GLU 34 N -4.26 1.42 0.00 1.97 4.07 0.44 -5.04 120.64 119.25 2k39 n GLU 34 Ca -0.37 -0.07 0.00 0.00 -0.06 0.00 0.00 57.16 56.66 2k39 n GLU 34 Cb 0.77 -1.22 0.00 0.00 -0.06 0.00 0.00 31.44 30.93 2k39 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2k39 n GLY 35 N 1.57 3.18 3.70 8.31 0.00 0.28 -4.97 105.19 117.26 2k39 n GLY 35 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2k39 n GLY 35 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2k39 s ILE 36 N -2.90 3.25 0.20 -0.61 1.10 -1.26 -4.94 121.20 116.04 2k39 s ILE 36 Ca 0.00 0.82 -0.30 0.00 -0.51 0.00 0.00 60.65 60.66 2k39 s ILE 36 Cb 0.00 -3.52 -0.08 0.00 0.15 0.00 0.00 42.46 39.01 2k39 s ILE 36 CO 0.00 0.04 1.05 -2.16 -2.11 0.00 0.00 174.94 171.76 2k39 s PRO 37 N 1.71 4.66 0.30 3.50 0.04 -1.26 -4.33 135.00 139.61 2k39 s PRO 37 Ca 0.67 1.66 0.20 0.00 0.04 0.00 0.00 61.00 63.57 2k39 s PRO 37 Cb -0.37 -3.28 1.04 0.00 0.04 0.00 0.00 34.50 31.93 2k39 s PRO 37 CO 0.30 0.19 1.15 -2.30 0.04 0.00 0.00 177.00 176.38 2k39 n PRO 38 N 2.08 -0.03 -0.33 0.56 -0.02 -1.26 -0.56 135.00 135.43 2k39 n PRO 38 Ca 0.01 0.96 0.24 0.00 -2.02 0.00 0.00 63.50 62.69 2k39 n PRO 38 Cb 0.46 -1.81 0.47 0.00 -0.02 0.00 0.00 33.50 32.61 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 0.43 -0.42 2.55 3.58 -2.00 -1.89 116.42 118.68 2k39 h ASP 39 Ca 0.63 0.20 0.00 0.00 0.42 0.00 0.00 57.03 58.29 2k39 h ASP 39 Cb 1.87 0.17 0.00 0.00 1.72 0.00 0.00 39.33 43.09 2k39 h ASP 39 CO -0.45 -0.18 0.00 0.00 -2.88 0.00 0.00 179.24 175.73 2k39 n GLN 40 N -5.10 2.98 -3.89 0.28 6.02 0.28 -4.96 117.38 112.99 2k39 n GLN 40 Ca 0.32 -2.38 -0.36 0.00 -0.01 0.00 0.00 57.00 54.57 2k39 n GLN 40 Cb 1.00 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 30.70 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 -1.44 3.69 -0.01 -1.09 -0.21 -0.71 -3.23 119.66 116.66 2k39 s GLN 41 Ca 0.33 -0.20 0.04 0.00 0.02 0.00 0.00 55.36 55.55 2k39 s GLN 41 Cb 0.20 -3.23 -0.01 0.00 1.00 0.00 0.00 33.01 30.97 2k39 s GLN 41 CO 0.18 0.57 -0.13 1.03 -2.12 0.00 0.00 175.29 174.82 2k39 s ARG 42 N -0.44 1.03 -0.18 2.91 0.52 -1.07 -4.94 118.95 116.77 2k39 s ARG 42 Ca 0.11 -0.46 0.01 0.00 -0.52 0.00 0.00 55.73 54.88 2k39 s ARG 42 Cb -0.12 -0.99 0.03 0.00 0.52 0.00 0.00 34.95 34.39 2k39 s ARG 42 CO 0.02 0.27 -0.18 -0.51 0.02 0.00 0.00 175.30 174.92 2k39 s LEU 43 N -0.31 2.18 -0.03 2.53 1.02 -1.26 -1.71 118.68 121.10 2k39 s LEU 43 Ca 0.05 -0.70 0.07 0.00 0.02 0.00 0.00 54.13 53.57 2k39 s LEU 43 Cb -0.05 -1.42 -0.02 0.00 0.02 0.00 0.00 46.19 44.72 2k39 s LEU 43 CO -0.00 -0.04 -0.26 -0.63 0.02 0.00 0.00 176.35 175.44 2k39 s ILE 44 N 1.31 2.05 -0.30 -0.59 -1.09 -0.06 -0.92 121.20 121.60 2k39 s ILE 44 Ca 0.03 -1.09 -0.01 0.00 -2.23 0.00 0.00 60.65 57.35 2k39 s ILE 44 Cb -0.14 -1.71 0.10 0.00 -1.58 0.00 0.00 42.46 39.13 2k39 s ILE 44 CO -0.12 0.58 0.10 0.12 -1.23 0.00 0.00 174.94 174.39 2k39 s PHE 45 N -0.45 1.42 0.00 3.97 5.36 -0.03 -1.72 117.98 126.52 2k39 s PHE 45 Ca 0.05 -1.53 0.00 0.00 -0.96 0.00 0.00 56.93 54.50 2k39 s PHE 45 Cb -0.11 -1.52 0.00 0.00 -0.34 0.00 0.00 43.02 41.04 2k39 s PHE 45 CO 0.01 -0.85 0.00 0.00 -1.46 0.00 0.00 175.22 172.91 2k39 n ALA 46 N 4.93 0.00 -0.20 11.12 0.00 -1.26 -0.94 120.51 134.16 2k39 n ALA 46 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2k39 n ALA 46 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 0.00 0.27 3.73 0.00 0.00 -1.26 -5.06 105.19 102.87 2k39 n GLY 47 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.36 4.41 -0.16 1.61 1.02 -0.11 -5.04 119.74 121.11 2k39 s LYS 48 Ca 0.00 0.83 -0.25 0.00 0.02 0.00 0.00 55.97 56.57 2k39 s LYS 48 Cb 0.00 -3.42 -0.02 0.00 -0.52 0.00 0.00 37.83 33.87 2k39 s LYS 48 CO 0.00 0.14 0.80 -0.65 -0.92 0.00 0.00 175.35 174.73 2k39 s GLN 49 N 0.54 4.30 0.19 1.68 1.11 -1.26 -0.85 119.66 125.38 2k39 s GLN 49 Ca 0.35 0.97 0.04 0.00 0.01 0.00 0.00 55.36 56.74 2k39 s GLN 49 Cb -0.18 -3.56 -0.03 0.00 -1.01 0.00 0.00 33.01 28.23 2k39 s GLN 49 CO 0.18 -0.28 0.28 -0.51 0.01 0.00 0.00 175.29 174.97 2k39 s LEU 50 N 1.99 4.22 -0.04 2.90 1.43 -0.10 -5.01 118.68 124.07 2k39 s LEU 50 Ca 0.37 0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.56 2k39 s LEU 50 Cb -0.17 -2.78 0.01 0.00 0.03 0.00 0.00 46.19 43.28 2k39 s LEU 50 CO 0.13 0.00 -0.11 -0.70 0.23 0.00 0.00 176.35 175.90 2k39 s GLU 51 N -3.55 1.30 0.00 1.70 2.12 -1.26 -4.69 118.70 114.32 2k39 s GLU 51 Ca 0.34 -0.38 0.00 0.00 0.36 0.00 0.00 54.97 55.28 2k39 s GLU 51 Cb -0.10 -1.15 0.00 0.00 0.26 0.00 0.00 34.13 33.14 2k39 s GLU 51 CO 0.28 0.11 0.00 -0.40 -0.54 0.00 0.00 175.26 174.71 2k39 n ASP 52 N 3.42 -0.85 0.00 -1.70 5.68 -1.26 -4.77 116.55 117.07 2k39 n ASP 52 Ca -0.20 -0.44 0.00 0.00 -0.50 0.00 0.00 54.79 53.66 2k39 n ASP 52 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 2k39 n ASP 52 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2k39 n GLY 53 N 2.53 0.63 3.22 6.12 0.00 -1.26 -5.00 105.19 111.42 2k39 n GLY 53 Ca 0.00 0.00 -0.09 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 -0.88 0.86 0.87 1.61 0.52 -1.26 -5.03 118.95 115.64 2k39 s ARG 54 Ca 0.00 -0.88 -0.11 0.00 -0.52 0.00 0.00 55.73 54.21 2k39 s ARG 54 Cb 0.00 0.35 0.16 0.00 0.52 0.00 0.00 34.95 35.99 2k39 s ARG 54 CO 0.00 -0.28 1.21 0.95 0.02 0.00 0.00 175.30 177.20 2k39 s THR 55 N -3.69 2.05 0.33 0.02 -4.23 -1.26 -2.19 115.64 106.68 2k39 s THR 55 Ca 0.03 -0.16 0.06 0.00 -1.18 0.00 0.00 61.69 60.44 2k39 s THR 55 Cb 0.04 -2.89 0.12 0.00 1.34 0.00 0.00 72.50 71.10 2k39 s THR 55 CO -0.10 0.00 1.82 -0.07 -0.54 0.00 0.00 174.62 175.73 2k39 h LEU 56 N -1.26 0.38 0.00 4.79 3.38 -1.47 -2.83 115.31 118.30 2k39 h LEU 56 Ca -0.43 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.45 2k39 h LEU 56 Cb 1.26 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2k39 h LEU 56 CO 0.42 0.56 -0.29 -0.24 0.09 0.00 0.00 178.44 178.99 2k39 n SER 57 N -4.20 0.32 0.22 -0.43 2.88 -1.16 -0.65 113.62 110.60 2k39 n SER 57 Ca -0.00 0.11 0.06 0.00 -1.33 0.00 0.00 58.87 57.71 2k39 n SER 57 Cb 0.33 -0.10 0.49 0.00 -0.75 0.00 0.00 64.21 64.18 2k39 n SER 57 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2k39 h ASP 58 N 0.00 0.00 0.00 -3.46 3.32 -1.80 -3.25 116.42 111.23 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 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 2k39 h ASP 58 CO 0.00 0.26 -0.05 -1.22 -1.72 0.00 0.00 179.24 176.51 2k39 n TYR 59 N -4.01 0.00 -3.88 4.55 4.01 -1.12 -4.99 117.16 111.72 2k39 n TYR 59 Ca -0.02 -0.74 -0.29 0.00 -0.16 0.00 0.00 57.90 56.69 2k39 n TYR 59 Cb 0.33 -0.11 0.03 0.00 -0.31 0.00 0.00 39.34 39.28 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 -1.01 -4.75 -4.51 7.72 5.15 -0.93 -4.95 115.26 111.97 2k39 n ASN 60 Ca 0.10 -0.76 -0.44 0.00 -0.60 0.00 0.00 54.58 52.88 2k39 n ASN 60 Cb 0.54 -3.98 -0.00 0.00 -0.53 0.00 0.00 39.78 35.82 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2k39 s ILE 61 N -3.32 4.64 -0.55 -1.44 1.01 0.18 -4.83 121.20 116.89 2k39 s ILE 61 Ca 0.63 -2.29 0.01 0.00 0.00 0.00 0.00 60.65 59.00 2k39 s ILE 61 Cb -0.31 -5.03 0.51 0.00 0.01 0.00 0.00 42.46 37.65 2k39 s ILE 61 CO 0.82 -1.79 1.89 0.00 0.00 0.00 0.00 174.94 175.86 2k39 n GLN 62 N 6.83 2.59 0.00 2.79 1.13 -1.26 -4.57 117.38 124.89 2k39 n GLN 62 Ca 0.41 -3.29 0.00 0.00 -1.94 0.00 0.00 57.00 52.18 2k39 n GLN 62 Cb 0.44 -2.22 0.00 0.00 0.11 0.00 0.00 30.24 28.57 2k39 n GLN 62 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2k39 n LYS 63 N -0.98 0.00 -1.53 -1.09 5.02 -1.26 -4.92 118.16 113.40 2k39 n LYS 63 Ca 0.58 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.80 2k39 n LYS 63 Cb 0.99 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.98 2k39 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2k39 n GLU 64 N 2.17 -0.50 -2.24 1.97 4.71 -0.76 -5.02 120.64 120.97 2k39 n GLU 64 Ca 0.00 0.60 -0.39 0.00 -0.01 0.00 0.00 57.16 57.35 2k39 n GLU 64 Cb 0.00 -4.42 -0.02 0.00 -1.01 0.00 0.00 31.44 25.99 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 -2.84 6.66 -0.28 1.62 0.01 -1.26 -4.80 113.70 112.80 2k39 s SER 65 Ca 0.00 2.46 -0.16 0.00 1.31 0.00 0.00 55.95 59.56 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 -0.59 0.42 -0.89 0.41 0.00 0.00 173.24 172.59 2k39 s THR 66 N -1.29 5.13 -0.10 1.44 2.01 -1.26 -1.05 115.64 120.53 2k39 s THR 66 Ca 0.53 0.57 -0.01 0.00 0.31 0.00 0.00 61.69 63.09 2k39 s THR 66 Cb -0.34 -3.76 -0.03 0.00 0.01 0.00 0.00 72.50 68.37 2k39 s THR 66 CO 0.44 0.08 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.64 2k39 s LEU 67 N 2.15 3.27 -0.25 4.42 2.01 0.14 -4.77 118.68 125.66 2k39 s LEU 67 Ca 0.16 -0.02 -0.08 0.00 0.01 0.00 0.00 54.13 54.21 2k39 s LEU 67 Cb -0.16 -1.74 -0.03 0.00 0.01 0.00 0.00 46.19 44.27 2k39 s LEU 67 CO 0.10 0.31 0.09 -2.28 1.01 0.00 0.00 176.35 175.58 2k39 s HIS 68 N -0.49 3.12 -0.34 0.29 5.65 -0.70 -1.06 115.29 121.75 2k39 s HIS 68 Ca 0.08 -0.30 -0.19 0.00 0.25 0.00 0.00 55.06 54.90 2k39 s HIS 68 Cb -0.12 -2.25 -0.00 0.00 -1.18 0.00 0.00 32.58 29.02 2k39 s HIS 68 CO 0.02 -0.29 0.56 -1.17 -0.65 0.00 0.00 174.74 173.20 2k39 s LEU 69 N 1.57 4.28 -0.41 8.88 2.96 0.57 -0.88 118.68 135.64 2k39 s LEU 69 Ca 0.06 0.11 -0.29 0.00 -0.22 0.00 0.00 54.13 53.79 2k39 s LEU 69 Cb -0.15 -2.67 0.01 0.00 0.50 0.00 0.00 46.19 43.88 2k39 s LEU 69 CO 0.05 -0.49 1.45 -0.69 -1.32 0.00 0.00 176.35 175.34 2k39 s VAL 70 N 2.49 3.86 0.17 1.68 1.01 -0.69 -4.28 120.40 124.63 2k39 s VAL 70 Ca 0.21 0.87 -0.30 0.00 0.00 0.00 0.00 61.98 62.76 2k39 s VAL 70 Cb -0.15 -4.16 -0.07 0.00 0.00 0.00 0.00 36.38 32.00 2k39 s VAL 70 CO 0.13 -0.74 1.02 -0.22 0.00 0.00 0.00 175.10 175.29 2k39 s LEU 71 N 5.60 4.53 -0.17 3.92 1.98 -1.26 -2.61 118.68 130.67 2k39 s LEU 71 Ca 0.63 1.96 -0.29 0.00 -2.89 0.00 0.00 54.13 53.54 2k39 s LEU 71 Cb -0.14 -3.60 -0.01 0.00 0.66 0.00 0.00 46.19 43.10 2k39 s LEU 71 CO 0.33 -0.08 1.19 -0.60 -1.89 0.00 0.00 176.35 175.30 2k39 s ARG 72 N -0.45 4.26 -0.05 1.98 3.52 -1.20 -4.98 118.95 122.02 2k39 s ARG 72 Ca 0.47 1.58 -0.05 0.00 -0.13 0.00 0.00 55.73 57.60 2k39 s ARG 72 Cb -0.27 -3.70 0.01 0.00 -1.56 0.00 0.00 34.95 29.43 2k39 s ARG 72 CO 0.33 -0.64 0.14 -0.51 -0.81 0.00 0.00 175.30 173.81 2k39 s LEU 73 N 3.22 1.45 -0.09 -0.88 1.43 -1.26 -5.04 118.68 117.51 2k39 s LEU 73 Ca 0.52 0.29 0.17 0.00 -1.03 0.00 0.00 54.13 54.08 2k39 s LEU 73 Cb -0.20 0.50 -0.23 0.00 0.03 0.00 0.00 46.19 46.28 2k39 s LEU 73 CO 0.14 -0.05 0.40 -1.14 0.23 0.00 0.00 176.35 175.93 2k39 n ARG 74 N 2.99 0.66 0.00 1.70 0.63 -1.26 -4.88 116.66 116.50 2k39 n ARG 74 Ca -0.12 0.08 0.00 0.00 -0.92 0.00 0.00 57.85 56.89 2k39 n ARG 74 Cb 0.59 -1.64 0.00 0.00 0.45 0.00 0.00 32.46 31.86 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 1.57 1.94 0.00 5.14 0.00 -1.26 -5.35 105.19 107.24 2k39 n GLY 75 Ca -0.21 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93