#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 3.63 0.28 2.12 0.00 -1.26 -0.56 119.66 123.86 2k39 s GLN 2 Ca 0.00 0.01 0.10 0.00 -0.00 0.00 0.00 55.36 55.47 2k39 s GLN 2 Cb 0.00 -3.22 -0.05 0.00 0.00 0.00 0.00 33.01 29.74 2k39 s GLN 2 CO 0.00 0.71 -0.15 0.96 0.00 0.00 0.00 175.29 176.81 2k39 s ILE 3 N -0.91 2.19 -0.18 3.63 -4.36 -0.79 -1.52 121.20 119.26 2k39 s ILE 3 Ca 0.17 -2.30 -0.06 0.00 -0.26 0.00 0.00 60.65 58.20 2k39 s ILE 3 Cb -0.13 -2.34 -0.04 0.00 1.25 0.00 0.00 42.46 41.20 2k39 s ILE 3 CO 0.06 -0.39 0.04 -0.36 0.24 0.00 0.00 174.94 174.53 2k39 s PHE 4 N -2.68 3.18 -0.23 1.37 0.08 -0.93 -1.39 117.98 117.39 2k39 s PHE 4 Ca 0.29 -0.05 -0.10 0.00 0.12 0.00 0.00 56.93 57.19 2k39 s PHE 4 Cb -0.02 -2.05 -0.05 0.00 -0.57 0.00 0.00 43.02 40.33 2k39 s PHE 4 CO 0.13 0.08 0.14 0.08 -0.10 0.00 0.00 175.22 175.55 2k39 s VAL 5 N 0.43 5.24 0.24 -0.44 1.01 -0.42 -2.06 120.40 124.41 2k39 s VAL 5 Ca 0.01 0.14 0.10 0.00 0.00 0.00 0.00 61.98 62.23 2k39 s VAL 5 Cb -0.13 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 2k39 s VAL 5 CO 0.01 0.37 -0.08 -0.75 0.00 0.00 0.00 175.10 174.65 2k39 s LYS 6 N 0.91 2.07 0.22 2.72 2.20 0.56 -0.77 119.74 127.65 2k39 s LYS 6 Ca 0.07 -1.46 0.01 0.00 -0.36 0.00 0.00 55.97 54.23 2k39 s LYS 6 Cb -0.13 -2.06 -0.05 0.00 -1.51 0.00 0.00 37.83 34.08 2k39 s LYS 6 CO 0.03 0.38 0.07 0.95 -0.36 0.00 0.00 175.35 176.41 2k39 s THR 7 N -2.18 0.52 0.29 3.43 -4.23 -1.13 0.06 115.64 112.40 2k39 s THR 7 Ca 0.29 -1.99 0.18 0.00 -1.18 0.00 0.00 61.69 58.99 2k39 s THR 7 Cb -0.07 -2.43 0.14 0.00 1.34 0.00 0.00 72.50 71.48 2k39 s THR 7 CO 0.17 -0.18 1.82 0.25 -0.54 0.00 0.00 174.62 176.14 2k39 h LEU 8 N 2.53 0.00 -0.58 4.79 5.85 -1.90 -1.60 115.31 124.41 2k39 h LEU 8 Ca -0.37 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.35 2k39 h LEU 8 Cb 1.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2k39 h LEU 8 CO 0.60 0.35 0.00 0.35 -0.34 0.00 0.00 178.44 179.40 2k39 n THR 9 N -3.77 0.10 0.00 1.05 -2.24 -1.26 -4.90 114.28 103.25 2k39 n THR 9 Ca -0.01 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2k39 n THR 9 Cb 0.43 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 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 0.98 3.12 3.67 3.38 0.00 -0.60 -4.98 105.19 110.75 2k39 n GLY 10 Ca 0.16 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.63 2k39 n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2k39 n LYS 11 N -1.05 1.42 -4.07 1.61 4.81 -1.26 -4.62 118.16 115.00 2k39 n LYS 11 Ca 0.00 0.51 -0.33 0.00 -0.87 0.00 0.00 58.31 57.62 2k39 n LYS 11 Cb 0.00 -2.29 -0.15 0.00 0.02 0.00 0.00 35.03 32.60 2k39 n LYS 11 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2k39 s THR 12 N 4.18 2.29 0.08 3.15 2.01 -1.26 -2.84 115.64 123.26 2k39 s THR 12 Ca 0.98 -1.08 -0.25 0.00 0.31 0.00 0.00 61.69 61.65 2k39 s THR 12 Cb -0.95 -2.09 -0.06 0.00 0.01 0.00 0.00 72.50 69.41 2k39 s THR 12 CO 0.60 0.35 0.79 -0.63 -0.69 0.00 0.00 174.62 175.04 2k39 s ILE 13 N 1.27 4.61 -0.09 1.82 1.01 0.05 -4.98 121.20 124.89 2k39 s ILE 13 Ca 0.01 1.69 -0.16 0.00 0.00 0.00 0.00 60.65 62.19 2k39 s ILE 13 Cb -0.15 -4.14 -0.05 0.00 0.01 0.00 0.00 42.46 38.13 2k39 s ILE 13 CO -0.09 0.40 0.41 -0.89 0.00 0.00 0.00 174.94 174.77 2k39 s THR 14 N -0.36 5.16 0.01 2.92 2.01 -1.26 -1.30 115.64 122.82 2k39 s THR 14 Ca 0.38 0.82 0.06 0.00 0.31 0.00 0.00 61.69 63.26 2k39 s THR 14 Cb -0.21 -3.74 -0.02 0.00 0.01 0.00 0.00 72.50 68.54 2k39 s THR 14 CO 0.24 0.43 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.68 2k39 s LEU 15 N -0.02 2.09 -0.08 4.42 1.43 -0.48 -4.94 118.68 121.09 2k39 s LEU 15 Ca 0.23 -0.38 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 2k39 s LEU 15 Cb -0.15 -0.84 -0.02 0.00 0.03 0.00 0.00 46.19 45.21 2k39 s LEU 15 CO 0.10 0.17 -0.13 -1.61 0.23 0.00 0.00 176.35 175.10 2k39 s GLU 16 N -0.69 2.87 0.33 1.70 0.41 -1.26 -1.88 118.70 120.17 2k39 s GLU 16 Ca 0.06 -0.68 -0.07 0.00 -0.41 0.00 0.00 54.97 53.87 2k39 s GLU 16 Cb -0.07 -2.49 0.03 0.00 -1.78 0.00 0.00 34.13 29.81 2k39 s GLU 16 CO 0.00 0.46 0.55 1.33 -0.49 0.00 0.00 175.26 177.12 2k39 n VAL 17 N 2.79 0.00 -3.96 2.63 0.24 0.27 -4.92 118.33 115.37 2k39 n VAL 17 Ca -0.18 -1.27 -0.10 0.00 -2.04 0.00 0.00 64.34 60.76 2k39 n VAL 17 Cb 0.52 0.93 -0.12 0.00 -1.47 0.00 0.00 33.84 33.71 2k39 n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2k39 s GLU 18 N -2.43 0.26 0.29 7.34 0.41 -1.26 0.73 118.70 124.04 2k39 s GLU 18 Ca 0.21 -0.49 0.04 0.00 -0.41 0.00 0.00 54.97 54.32 2k39 s GLU 18 Cb -0.02 0.07 0.71 0.00 -1.78 0.00 0.00 34.13 33.10 2k39 s GLU 18 CO 0.15 -0.03 1.73 -1.35 -0.49 0.00 0.00 175.26 175.27 2k39 h PRO 19 N 4.96 0.54 -0.56 0.39 0.11 -1.95 0.43 132.00 135.91 2k39 h PRO 19 Ca -0.31 -0.03 0.16 0.00 0.11 0.00 0.00 66.00 65.93 2k39 h PRO 19 Cb 1.21 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2k39 h PRO 19 CO 0.43 0.36 0.57 0.66 -0.21 0.00 0.00 178.00 179.81 2k39 h SER 20 N 0.56 0.00 -2.94 -2.05 4.64 -1.96 -0.07 113.55 111.72 2k39 h SER 20 Ca 0.55 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 61.34 2k39 h SER 20 Cb 0.96 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.05 2k39 h SER 20 CO -0.45 0.00 0.79 -1.81 -0.87 0.00 0.00 176.83 174.49 2k39 s ASP 21 N -5.09 6.85 0.58 4.97 1.11 0.15 -4.79 116.67 120.44 2k39 s ASP 21 Ca -0.04 2.18 -0.19 0.00 0.18 0.00 0.00 52.55 54.68 2k39 s ASP 21 Cb 0.16 -2.57 -0.04 0.00 1.07 0.00 0.00 42.92 41.54 2k39 s ASP 21 CO 0.57 -0.69 1.20 0.42 1.18 0.00 0.00 175.17 177.84 2k39 s THR 22 N 1.96 2.73 -0.99 -1.27 -4.23 -1.26 -2.11 115.64 110.48 2k39 s THR 22 Ca 0.64 0.46 -0.21 0.00 -1.18 0.00 0.00 61.69 61.41 2k39 s THR 22 Cb -0.33 -3.19 0.09 0.00 1.34 0.00 0.00 72.50 70.41 2k39 s THR 22 CO 0.28 -0.09 1.31 -0.63 -0.54 0.00 0.00 174.62 174.94 2k39 s ILE 23 N -1.61 4.32 0.11 2.99 -1.09 0.35 -3.16 121.20 123.11 2k39 s ILE 23 Ca 0.76 -1.20 0.00 0.00 -2.23 0.00 0.00 60.65 57.98 2k39 s ILE 23 Cb -0.29 -4.93 0.00 0.00 -1.58 0.00 0.00 42.46 35.66 2k39 s ILE 23 CO 0.32 -1.74 0.00 1.21 -1.23 0.00 0.00 174.94 173.51 2k39 n GLU 24 N 7.73 0.00 -0.09 2.79 4.07 -1.26 -1.58 120.64 132.30 2k39 n GLU 24 Ca 0.29 0.00 -0.13 0.00 -0.06 0.00 0.00 57.16 57.26 2k39 n GLU 24 Cb 0.50 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.86 2k39 n GLU 24 CO 0.00 0.00 0.00 -0.97 -0.06 0.00 0.00 177.13 176.10 2k39 h ASN 25 N 0.00 0.95 -0.83 4.31 -0.73 -1.94 -2.67 115.58 114.68 2k39 h ASN 25 Ca 0.00 -0.47 0.19 0.00 1.87 0.00 0.00 56.30 57.89 2k39 h ASN 25 Cb 0.00 -0.27 -0.12 0.00 0.27 0.00 0.00 38.32 38.20 2k39 h ASN 25 CO 0.00 1.26 0.27 0.58 -0.37 0.00 0.00 177.43 179.17 2k39 h VAL 26 N 0.70 0.47 0.00 2.57 2.07 -1.93 -2.73 116.25 117.39 2k39 h VAL 26 Ca 0.04 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2k39 h VAL 26 Cb 1.06 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2k39 h VAL 26 CO 0.11 0.06 0.00 0.11 0.02 0.00 0.00 177.57 177.86 2k39 h LYS 27 N 0.32 0.00 0.14 1.57 1.57 -1.77 -2.32 116.57 116.07 2k39 h LYS 27 Ca 0.49 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.98 2k39 h LYS 27 Cb 0.90 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.22 2k39 h LYS 27 CO -0.54 0.00 -1.37 0.00 -0.57 0.00 0.00 179.45 176.97 2k39 h ALA 28 N 2.20 0.11 -0.28 3.86 0.00 -1.49 -2.64 119.26 121.02 2k39 h ALA 28 Ca 0.00 -0.95 -0.12 0.00 0.00 0.00 0.00 54.91 53.84 2k39 h ALA 28 Cb 0.46 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2k39 h ALA 28 CO 0.00 0.99 -0.32 0.87 0.00 0.00 0.00 179.25 180.78 2k39 h LYS 29 N 0.08 0.59 -0.11 0.00 1.57 -1.45 -2.16 116.57 115.10 2k39 h LYS 29 Ca -0.18 -0.27 -0.05 0.00 -1.87 0.00 0.00 60.65 58.28 2k39 h LYS 29 Cb 2.01 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 34.31 2k39 h LYS 29 CO 0.20 0.84 -0.14 0.82 -0.57 0.00 0.00 179.45 180.60 2k39 h ILE 30 N 0.50 1.37 -0.53 1.86 1.08 -1.55 -2.48 117.51 117.75 2k39 h ILE 30 Ca 0.06 -1.34 0.06 0.00 -0.39 0.00 0.00 64.86 63.24 2k39 h ILE 30 Cb 0.81 2.00 -0.05 0.00 -3.07 0.00 0.00 36.82 36.51 2k39 h ILE 30 CO 0.07 0.39 0.24 -0.61 -0.69 0.00 0.00 178.15 177.54 2k39 h GLN 31 N -0.13 0.45 -0.37 2.37 4.15 -1.19 0.28 115.11 120.67 2k39 h GLN 31 Ca 0.01 -0.03 0.07 0.00 0.77 0.00 0.00 58.65 59.48 2k39 h GLN 31 Cb 0.68 -0.10 -0.09 0.00 0.21 0.00 0.00 27.48 28.18 2k39 h GLN 31 CO 0.03 0.30 -0.39 0.22 -1.93 0.00 0.00 178.83 177.06 2k39 h ASP 32 N 0.46 -1.28 -0.15 -0.69 1.82 -1.37 0.30 116.42 115.51 2k39 h ASP 32 Ca 0.25 0.20 -0.02 0.00 -0.39 0.00 0.00 57.03 57.07 2k39 h ASP 32 Cb 0.21 0.57 -0.01 0.00 0.68 0.00 0.00 39.33 40.79 2k39 h ASP 32 CO -0.21 -0.36 0.01 0.11 -1.61 0.00 0.00 179.24 177.18 2k39 h LYS 33 N -0.32 0.26 0.00 0.28 1.57 -1.11 -3.42 116.57 113.84 2k39 h LYS 33 Ca 0.15 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2k39 h LYS 33 Cb 0.57 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.86 2k39 h LYS 33 CO -0.54 0.48 -0.43 0.39 -0.57 0.00 0.00 179.45 178.77 2k39 n GLU 34 N -4.77 3.07 0.00 3.15 -0.58 0.96 -5.03 120.64 117.44 2k39 n GLU 34 Ca -0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 2k39 n GLU 34 Cb 0.21 -0.66 0.00 0.00 -0.57 0.00 0.00 31.44 30.41 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 1.39 0.83 3.61 0.62 0.00 0.10 -4.99 105.19 106.76 2k39 n GLY 35 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 5.31 0.30 -0.61 1.01 -1.26 -5.02 121.20 118.94 2k39 s ILE 36 Ca 0.00 0.22 -0.30 0.00 0.00 0.00 0.00 60.65 60.57 2k39 s ILE 36 Cb 0.00 -3.54 -0.12 0.00 0.01 0.00 0.00 42.46 38.81 2k39 s ILE 36 CO 0.00 0.27 1.60 -0.81 0.00 0.00 0.00 174.94 176.00 2k39 n PRO 37 N 4.85 2.72 -0.27 2.79 -0.05 -1.26 -4.30 135.00 139.48 2k39 n PRO 37 Ca -0.14 0.97 0.24 0.00 -0.05 0.00 0.00 63.50 64.52 2k39 n PRO 37 Cb 0.52 -2.75 0.42 0.00 -0.05 0.00 0.00 33.50 31.64 2k39 n PRO 37 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 175.50 173.15 2k39 n PRO 38 N 2.08 -0.03 0.07 0.54 -0.02 -1.26 -1.03 135.00 135.35 2k39 n PRO 38 Ca 0.08 0.86 -0.10 0.00 -2.02 0.00 0.00 63.50 62.32 2k39 n PRO 38 Cb 0.37 -1.63 -0.13 0.00 -0.02 0.00 0.00 33.50 32.09 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 0.15 0.49 2.55 3.58 -1.98 -3.27 116.42 117.94 2k39 h ASP 39 Ca 0.57 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.85 2k39 h ASP 39 Cb 1.71 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.71 2k39 h ASP 39 CO -0.39 1.13 -0.60 0.00 -2.88 0.00 0.00 179.24 176.51 2k39 n GLN 40 N -3.40 0.06 -2.45 0.28 6.02 -0.20 -4.49 117.38 113.20 2k39 n GLN 40 Ca -0.04 0.01 -0.39 0.00 -0.01 0.00 0.00 57.00 56.56 2k39 n GLN 40 Cb 0.98 -1.53 -0.03 0.00 1.02 0.00 0.00 30.24 30.68 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 -3.03 3.23 -0.25 -1.09 -0.21 -0.84 -4.58 119.66 112.89 2k39 s GLN 41 Ca 0.10 -0.52 -0.19 0.00 0.02 0.00 0.00 55.36 54.76 2k39 s GLN 41 Cb 0.17 -4.78 -0.02 0.00 1.00 0.00 0.00 33.01 29.37 2k39 s GLN 41 CO 0.72 -2.37 0.56 1.03 -2.12 0.00 0.00 175.29 173.12 2k39 s ARG 42 N 5.70 4.10 -0.11 2.91 1.81 -0.76 -4.95 118.95 127.64 2k39 s ARG 42 Ca 0.47 0.42 0.01 0.00 -1.72 0.00 0.00 55.73 54.90 2k39 s ARG 42 Cb -0.05 -3.64 0.02 0.00 -0.45 0.00 0.00 34.95 30.83 2k39 s ARG 42 CO 0.04 -0.35 -0.13 -0.51 -0.68 0.00 0.00 175.30 173.67 2k39 s LEU 43 N 2.29 1.59 -0.02 2.53 1.43 -1.26 -0.71 118.68 124.53 2k39 s LEU 43 Ca 0.23 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.94 2k39 s LEU 43 Cb -0.16 -1.02 0.02 0.00 0.03 0.00 0.00 46.19 45.06 2k39 s LEU 43 CO 0.09 -0.02 -0.00 -0.63 0.23 0.00 0.00 176.35 176.01 2k39 s ILE 44 N 1.18 0.14 0.00 -0.59 1.09 -0.89 -2.87 121.20 119.26 2k39 s ILE 44 Ca -0.03 0.04 0.00 0.00 -1.10 0.00 0.00 60.65 59.55 2k39 s ILE 44 Cb -0.14 -0.19 0.00 0.00 -1.06 0.00 0.00 42.46 41.06 2k39 s ILE 44 CO -0.04 0.10 0.00 2.22 -0.10 0.00 0.00 174.94 177.12 2k39 n PHE 45 N 3.71 0.00 -2.71 3.97 -1.74 -1.26 -1.61 117.46 117.81 2k39 n PHE 45 Ca -0.21 0.00 -0.04 0.00 -0.56 0.00 0.00 57.45 56.64 2k39 n PHE 45 Cb 0.54 0.00 0.10 0.00 1.52 0.00 0.00 39.48 41.63 2k39 n PHE 45 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2k39 n ALA 46 N -1.57 2.51 0.00 1.98 0.00 -1.26 -5.00 120.51 117.17 2k39 n ALA 46 Ca 0.00 -1.73 0.00 0.00 0.00 0.00 0.00 53.44 51.71 2k39 n ALA 46 Cb 0.32 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.93 0.37 3.31 0.00 0.00 -1.26 -5.06 105.19 101.61 2k39 n GLY 47 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.80 0.69 0.35 1.61 -2.85 -1.26 -5.11 119.74 112.38 2k39 s LYS 48 Ca 0.00 0.08 -0.28 0.00 -1.00 0.00 0.00 55.97 54.77 2k39 s LYS 48 Cb 0.00 0.32 -0.12 0.00 -2.06 0.00 0.00 37.83 35.97 2k39 s LYS 48 CO 0.00 -0.18 1.34 1.04 0.10 0.00 0.00 175.35 177.65 2k39 n GLN 49 N 1.60 2.26 -2.85 1.78 1.13 -1.26 -4.54 117.38 115.50 2k39 n GLN 49 Ca -0.19 0.79 -0.40 0.00 -1.94 0.00 0.00 57.00 55.26 2k39 n GLN 49 Cb 0.56 -2.41 -0.05 0.00 0.11 0.00 0.00 30.24 28.45 2k39 n GLN 49 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2k39 s LEU 50 N -1.26 4.52 0.19 1.08 1.43 -1.14 -4.99 118.68 118.51 2k39 s LEU 50 Ca 0.55 1.69 -0.27 0.00 -1.03 0.00 0.00 54.13 55.07 2k39 s LEU 50 Cb -0.55 -3.43 -0.08 0.00 0.03 0.00 0.00 46.19 42.16 2k39 s LEU 50 CO 0.63 0.04 0.83 -0.70 0.23 0.00 0.00 176.35 177.38 2k39 s GLU 51 N -0.40 4.67 -0.40 1.70 2.12 -1.26 -4.98 118.70 120.15 2k39 s GLU 51 Ca 0.42 1.27 -0.41 0.00 0.36 0.00 0.00 54.97 56.61 2k39 s GLU 51 Cb -0.23 -3.27 -0.16 0.00 0.26 0.00 0.00 34.13 30.73 2k39 s GLU 51 CO 0.28 0.55 1.99 -3.47 -0.54 0.00 0.00 175.26 174.06 2k39 n ASP 52 N 1.59 1.64 0.00 -1.70 2.03 -1.26 -3.21 116.55 115.64 2k39 n ASP 52 Ca -0.04 0.76 0.00 0.00 0.52 0.00 0.00 54.79 56.03 2k39 n ASP 52 Cb 0.48 -1.07 0.00 0.00 -0.72 0.00 0.00 41.12 39.81 2k39 n ASP 52 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k39 n GLY 53 N 5.95 0.51 3.85 0.27 0.00 -0.61 -5.05 105.19 110.11 2k39 n GLY 53 Ca 0.41 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.70 3.85 0.57 1.61 1.81 -1.20 -4.79 118.95 120.11 2k39 s ARG 54 Ca 0.00 0.31 -0.06 0.00 -1.72 0.00 0.00 55.73 54.26 2k39 s ARG 54 Cb 0.00 -3.12 -0.00 0.00 -0.45 0.00 0.00 34.95 31.38 2k39 s ARG 54 CO 0.00 0.64 0.88 0.95 -0.68 0.00 0.00 175.30 177.09 2k39 s THR 55 N -1.21 3.90 0.24 0.02 -4.23 -1.26 -0.49 115.64 112.59 2k39 s THR 55 Ca 0.28 0.04 -0.15 0.00 -1.18 0.00 0.00 61.69 60.68 2k39 s THR 55 Cb -0.15 -3.53 0.28 0.00 1.34 0.00 0.00 72.50 70.44 2k39 s THR 55 CO 0.15 -0.54 1.56 -0.07 -0.54 0.00 0.00 174.62 175.18 2k39 h LEU 56 N -0.10 -1.24 -1.24 4.79 4.07 -1.26 -1.87 115.31 118.47 2k39 h LEU 56 Ca -0.46 0.29 0.19 0.00 0.08 0.00 0.00 57.88 57.99 2k39 h LEU 56 Cb 1.25 0.69 -0.09 0.00 1.08 0.00 0.00 40.66 43.58 2k39 h LEU 56 CO 0.61 -0.30 0.61 -1.28 -1.08 0.00 0.00 178.44 177.00 2k39 h SER 57 N -0.02 0.62 0.74 -0.43 0.87 -1.28 -0.15 113.55 113.90 2k39 h SER 57 Ca 0.37 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.99 2k39 h SER 57 Cb 0.62 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.53 2k39 h SER 57 CO -0.95 0.24 0.00 0.44 -0.53 0.00 0.00 176.83 176.03 2k39 h ASP 58 N 0.62 0.00 0.18 6.23 3.32 -1.60 0.13 116.42 125.30 2k39 h ASP 58 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 2k39 h ASP 58 Cb 1.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.55 2k39 h ASP 58 CO -0.28 0.00 -1.17 -1.22 -1.72 0.00 0.00 179.24 174.85 2k39 n TYR 59 N -2.86 0.09 -2.30 4.55 4.01 -1.03 -4.99 117.16 114.64 2k39 n TYR 59 Ca 0.00 0.03 -0.08 0.00 -0.16 0.00 0.00 57.90 57.68 2k39 n TYR 59 Cb 0.24 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 39.01 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 -1.80 -3.09 -4.62 7.72 5.15 0.44 -4.98 115.26 114.08 2k39 n ASN 60 Ca 0.02 -0.04 -0.43 0.00 -0.60 0.00 0.00 54.58 53.53 2k39 n ASN 60 Cb 0.41 -2.26 -0.02 0.00 -0.53 0.00 0.00 39.78 37.38 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 -2.54 3.71 0.40 -1.44 1.01 -0.56 -4.97 121.20 116.80 2k39 s ILE 61 Ca 0.04 0.77 0.01 0.00 0.00 0.00 0.00 60.65 61.46 2k39 s ILE 61 Cb -0.02 -3.80 -0.02 0.00 0.01 0.00 0.00 42.46 38.63 2k39 s ILE 61 CO 0.05 -0.41 0.61 -1.10 0.00 0.00 0.00 174.94 174.09 2k39 s GLN 62 N 4.93 3.24 -0.46 2.79 -0.21 -1.26 -4.69 119.66 124.00 2k39 s GLN 62 Ca 0.71 -0.45 -0.44 0.00 0.02 0.00 0.00 55.36 55.20 2k39 s GLN 62 Cb -0.22 -2.61 -0.18 0.00 1.00 0.00 0.00 33.01 31.00 2k39 s GLN 62 CO 0.30 -0.08 1.88 0.36 -2.12 0.00 0.00 175.29 175.63 2k39 n LYS 63 N -1.94 0.26 -1.30 2.91 2.85 -1.26 -2.95 118.16 116.74 2k39 n LYS 63 Ca -0.01 0.09 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 2k39 n LYS 63 Cb 0.57 -1.68 0.00 0.00 -0.65 0.00 0.00 35.03 33.27 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 5.93 0.00 -3.25 -1.58 2.13 -0.58 -5.01 120.64 118.28 2k39 n GLU 64 Ca 0.40 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.84 2k39 n GLU 64 Cb 0.00 -2.22 -0.06 0.00 0.27 0.00 0.00 31.44 29.43 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 -2.64 6.85 -0.11 4.31 0.01 -1.15 -4.89 113.70 116.07 2k39 s SER 65 Ca 0.00 1.02 -0.27 0.00 1.31 0.00 0.00 55.95 58.00 2k39 s SER 65 Cb 0.00 -2.33 -0.02 0.00 0.21 0.00 0.00 66.02 63.88 2k39 s SER 65 CO 0.00 0.05 0.91 -0.89 0.41 0.00 0.00 173.24 173.72 2k39 s THR 66 N 0.20 4.86 -0.16 1.44 2.01 -1.26 -2.19 115.64 120.53 2k39 s THR 66 Ca 0.29 1.84 -0.00 0.00 0.31 0.00 0.00 61.69 64.13 2k39 s THR 66 Cb -0.17 -4.22 0.00 0.00 0.01 0.00 0.00 72.50 68.12 2k39 s THR 66 CO 0.14 0.06 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.22 2k39 s LEU 67 N 1.81 2.47 -0.24 4.42 1.02 -0.87 -4.76 118.68 122.53 2k39 s LEU 67 Ca 0.44 -0.48 -0.26 0.00 0.02 0.00 0.00 54.13 53.85 2k39 s LEU 67 Cb -0.18 -1.57 -0.00 0.00 0.02 0.00 0.00 46.19 44.46 2k39 s LEU 67 CO 0.17 0.07 0.88 -2.28 0.02 0.00 0.00 176.35 175.21 2k39 s HIS 68 N 0.93 3.32 -0.14 0.29 2.46 -0.64 -0.32 115.29 121.19 2k39 s HIS 68 Ca -0.03 1.23 -0.15 0.00 0.47 0.00 0.00 55.06 56.57 2k39 s HIS 68 Cb -0.15 -3.11 -0.05 0.00 -0.13 0.00 0.00 32.58 29.15 2k39 s HIS 68 CO -0.02 -0.42 0.36 -1.17 -2.47 0.00 0.00 174.74 171.03 2k39 s LEU 69 N 2.92 4.27 0.15 8.88 0.20 0.11 -2.10 118.68 133.10 2k39 s LEU 69 Ca 0.37 0.64 0.09 0.00 0.69 0.00 0.00 54.13 55.92 2k39 s LEU 69 Cb -0.15 -2.50 -0.04 0.00 -0.43 0.00 0.00 46.19 43.07 2k39 s LEU 69 CO 0.07 0.08 -0.21 0.68 -0.29 0.00 0.00 176.35 176.68 2k39 s VAL 70 N 0.44 1.91 -0.33 1.68 -7.23 0.11 -3.39 120.40 113.59 2k39 s VAL 70 Ca 0.20 -1.81 -0.01 0.00 -1.81 0.00 0.00 61.98 58.55 2k39 s VAL 70 Cb -0.14 -1.82 0.12 0.00 0.56 0.00 0.00 36.38 35.10 2k39 s VAL 70 CO 0.07 -0.17 0.17 -0.76 -0.31 0.00 0.00 175.10 174.09 2k39 s LEU 71 N -2.38 1.17 -0.12 1.32 1.43 -1.26 -1.84 118.68 117.00 2k39 s LEU 71 Ca 0.14 -1.81 0.00 0.00 -1.03 0.00 0.00 54.13 51.43 2k39 s LEU 71 Cb -0.08 -0.51 0.00 0.00 0.03 0.00 0.00 46.19 45.63 2k39 s LEU 71 CO 0.06 -0.37 0.00 -1.14 0.23 0.00 0.00 176.35 175.13 2k39 n ARG 72 N 4.57 -0.62 -4.63 1.70 0.63 -1.26 -5.00 116.66 112.05 2k39 n ARG 72 Ca 0.03 0.26 -0.34 0.00 -0.92 0.00 0.00 57.85 56.88 2k39 n ARG 72 Cb 0.39 -3.79 -0.11 0.00 0.45 0.00 0.00 32.46 29.40 2k39 n ARG 72 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2k39 s LEU 73 N -0.26 3.14 0.43 6.15 1.02 -1.26 -5.14 118.68 122.77 2k39 s LEU 73 Ca 0.00 -0.04 -0.00 0.00 0.02 0.00 0.00 54.13 54.11 2k39 s LEU 73 Cb 0.00 -1.68 -0.01 0.00 0.02 0.00 0.00 46.19 44.51 2k39 s LEU 73 CO 0.00 0.35 0.66 -0.13 0.02 0.00 0.00 176.35 177.25 2k39 s ARG 74 N -0.74 3.17 -0.50 1.70 0.52 -1.26 -4.97 118.95 116.88 2k39 s ARG 74 Ca 0.11 -0.42 0.04 0.00 -0.52 0.00 0.00 55.73 54.95 2k39 s ARG 74 Cb -0.11 -2.56 0.41 0.00 0.52 0.00 0.00 34.95 33.21 2k39 s ARG 74 CO 0.01 -0.19 1.25 0.41 0.02 0.00 0.00 175.30 176.80 2k39 n GLY 75 N -2.04 5.95 0.00 -3.53 0.00 -1.26 -5.19 105.19 99.12 2k39 n GLY 75 Ca 0.00 -2.72 0.00 0.00 0.00 0.00 0.00 46.02 43.30 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93