#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 4.51 0.37 3.17 1.11 -1.26 -1.79 119.66 125.76 2k39 s GLN 2 Ca 0.00 1.09 0.04 0.00 0.01 0.00 0.00 55.36 56.50 2k39 s GLN 2 Cb 0.00 -3.36 -0.06 0.00 -1.01 0.00 0.00 33.01 28.58 2k39 s GLN 2 CO 0.00 0.29 0.05 0.96 0.01 0.00 0.00 175.29 176.60 2k39 s ILE 3 N -0.10 1.31 0.01 1.08 -4.36 -0.53 -2.02 121.20 116.58 2k39 s ILE 3 Ca 0.39 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.81 2k39 s ILE 3 Cb -0.21 -2.75 -0.01 0.00 1.25 0.00 0.00 42.46 40.74 2k39 s ILE 3 CO 0.23 0.00 -0.10 -0.36 0.24 0.00 0.00 174.94 174.95 2k39 s PHE 4 N -3.12 0.89 -0.22 1.37 0.08 -1.13 -3.29 117.98 112.57 2k39 s PHE 4 Ca 0.32 -0.26 0.01 0.00 0.12 0.00 0.00 56.93 57.13 2k39 s PHE 4 Cb 0.08 -0.55 0.05 0.00 -0.57 0.00 0.00 43.02 42.02 2k39 s PHE 4 CO 0.15 -0.01 -0.10 0.14 -0.10 0.00 0.00 175.22 175.30 2k39 s VAL 5 N -0.56 1.75 0.06 -0.44 -7.23 -0.80 -1.54 120.40 111.64 2k39 s VAL 5 Ca 0.01 -1.16 -0.27 0.00 -1.81 0.00 0.00 61.98 58.75 2k39 s VAL 5 Cb -0.06 -1.85 -0.05 0.00 0.56 0.00 0.00 36.38 34.98 2k39 s VAL 5 CO 0.00 0.11 0.84 -0.75 -0.31 0.00 0.00 175.10 174.99 2k39 s LYS 6 N 1.33 4.57 0.30 4.82 2.20 -0.21 -0.68 119.74 132.06 2k39 s LYS 6 Ca -0.03 1.20 -0.14 0.00 -0.36 0.00 0.00 55.97 56.65 2k39 s LYS 6 Cb -0.17 -3.37 -0.08 0.00 -1.51 0.00 0.00 37.83 32.69 2k39 s LYS 6 CO -0.08 0.25 0.69 0.99 -0.36 0.00 0.00 175.35 176.84 2k39 s THR 7 N 0.00 4.74 0.61 3.43 2.01 0.82 0.77 115.64 128.02 2k39 s THR 7 Ca 0.42 0.83 0.36 0.00 0.31 0.00 0.00 61.69 63.60 2k39 s THR 7 Cb -0.21 -3.61 0.36 0.00 0.01 0.00 0.00 72.50 69.04 2k39 s THR 7 CO 0.25 -0.15 2.09 0.17 -0.69 0.00 0.00 174.62 176.30 2k39 h LEU 8 N 2.35 0.00 0.00 4.42 -0.00 -1.87 0.07 115.31 120.28 2k39 h LEU 8 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.40 2k39 h LEU 8 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.83 2k39 h LEU 8 CO 0.66 0.00 -0.12 0.71 -0.00 0.00 0.00 178.44 179.69 2k39 h THR 9 N 0.00 0.00 0.00 0.15 1.35 -1.94 -3.48 112.91 108.99 2k39 h THR 9 Ca 0.00 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 2k39 h THR 9 Cb 0.34 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 2k39 h THR 9 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2k39 n GLY 10 N 1.28 1.48 3.67 5.82 0.00 0.01 -5.09 105.19 112.36 2k39 n GLY 10 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 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 4.33 -0.52 1.61 2.20 -1.23 -4.80 119.74 121.33 2k39 s LYS 11 Ca 0.00 1.35 -0.25 0.00 -0.36 0.00 0.00 55.97 56.70 2k39 s LYS 11 Cb 0.00 -3.59 0.03 0.00 -1.51 0.00 0.00 37.83 32.76 2k39 s LYS 11 CO 0.00 -0.47 0.98 0.99 -0.36 0.00 0.00 175.35 176.49 2k39 s THR 12 N 2.61 4.36 -0.13 3.43 2.01 -1.26 -0.13 115.64 126.54 2k39 s THR 12 Ca 0.45 0.59 -0.23 0.00 0.31 0.00 0.00 61.69 62.81 2k39 s THR 12 Cb -0.17 -4.53 -0.03 0.00 0.01 0.00 0.00 72.50 67.79 2k39 s THR 12 CO 0.12 -1.04 0.70 -0.63 -0.69 0.00 0.00 174.62 173.08 2k39 s ILE 13 N 4.04 5.01 -0.04 1.82 -1.09 0.14 -4.95 121.20 126.13 2k39 s ILE 13 Ca 0.35 1.39 -0.20 0.00 -2.23 0.00 0.00 60.65 59.97 2k39 s ILE 13 Cb -0.11 -4.02 -0.05 0.00 -1.58 0.00 0.00 42.46 36.70 2k39 s ILE 13 CO 0.23 0.17 0.56 0.42 -1.23 0.00 0.00 174.94 175.09 2k39 s THR 14 N 1.40 5.01 -0.13 2.92 -4.23 -1.26 -1.91 115.64 117.44 2k39 s THR 14 Ca 0.35 1.16 -0.10 0.00 -1.18 0.00 0.00 61.69 61.92 2k39 s THR 14 Cb -0.17 -3.90 0.04 0.00 1.34 0.00 0.00 72.50 69.81 2k39 s THR 14 CO 0.14 0.38 0.33 -0.22 -0.54 0.00 0.00 174.62 174.71 2k39 s LEU 15 N 0.10 0.57 -0.10 4.79 2.96 -1.21 -5.00 118.68 120.80 2k39 s LEU 15 Ca 0.30 0.67 0.02 0.00 -0.22 0.00 0.00 54.13 54.91 2k39 s LEU 15 Cb -0.17 1.10 -0.01 0.00 0.50 0.00 0.00 46.19 47.60 2k39 s LEU 15 CO 0.15 -0.13 -0.17 -1.61 -1.32 0.00 0.00 176.35 173.26 2k39 s GLU 16 N 0.54 3.01 0.29 1.98 2.02 -1.26 -1.46 118.70 123.82 2k39 s GLU 16 Ca -0.03 -0.76 0.06 0.00 0.02 0.00 0.00 54.97 54.26 2k39 s GLU 16 Cb -0.04 -2.44 -0.02 0.00 0.10 0.00 0.00 34.13 31.72 2k39 s GLU 16 CO -0.03 0.31 0.20 1.33 0.02 0.00 0.00 175.26 177.10 2k39 n VAL 17 N 3.19 0.00 -4.40 2.63 0.24 -0.74 -4.99 118.33 114.26 2k39 n VAL 17 Ca -0.18 -1.99 -0.27 0.00 -2.04 0.00 0.00 64.34 59.86 2k39 n VAL 17 Cb 0.53 0.92 -0.12 0.00 -1.47 0.00 0.00 33.84 33.70 2k39 n VAL 17 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 2k39 s GLU 18 N -3.16 1.56 0.41 7.34 -1.05 -1.26 0.95 118.70 123.50 2k39 s GLU 18 Ca 0.28 -1.45 0.13 0.00 -0.15 0.00 0.00 54.97 53.79 2k39 s GLU 18 Cb 0.01 -1.90 0.97 0.00 -0.44 0.00 0.00 34.13 32.77 2k39 s GLU 18 CO 0.20 0.42 1.94 -1.00 0.95 0.00 0.00 175.26 177.77 2k39 h PRO 19 N 3.34 0.48 0.00 -4.83 0.13 -1.99 -2.41 132.00 126.72 2k39 h PRO 19 Ca -0.48 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2k39 h PRO 19 Cb 1.20 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2k39 h PRO 19 CO 0.47 0.32 0.00 -1.13 -0.23 0.00 0.00 178.00 177.42 2k39 n SER 20 N -4.48 0.00 -4.67 1.44 3.41 -1.26 -2.93 113.62 105.12 2k39 n SER 20 Ca 0.12 0.33 -0.46 0.00 -0.26 0.00 0.00 58.87 58.60 2k39 n SER 20 Cb 0.42 -0.43 -0.04 0.00 -0.26 0.00 0.00 64.21 63.90 2k39 n SER 20 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2k39 n ASP 21 N -1.43 3.69 -4.74 4.04 8.00 -0.91 -4.90 116.55 120.31 2k39 n ASP 21 Ca 0.07 0.95 -0.36 0.00 0.71 0.00 0.00 54.79 56.16 2k39 n ASP 21 Cb 0.24 -1.43 0.06 0.00 -0.02 0.00 0.00 41.12 39.97 2k39 n ASP 21 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2k39 s THR 22 N 4.10 2.21 0.51 -3.53 -4.23 -1.26 -3.13 115.64 110.30 2k39 s THR 22 Ca 0.91 0.13 0.41 0.00 -1.18 0.00 0.00 61.69 61.96 2k39 s THR 22 Cb -0.60 -3.03 0.41 0.00 1.34 0.00 0.00 72.50 70.61 2k39 s THR 22 CO 0.48 -0.03 2.24 0.40 -0.54 0.00 0.00 174.62 177.17 2k39 h ILE 23 N 0.59 0.00 0.00 2.99 1.08 -1.56 0.17 117.51 120.78 2k39 h ILE 23 Ca -0.51 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 63.89 2k39 h ILE 23 Cb 1.32 0.90 -0.01 0.00 -3.07 0.00 0.00 36.82 35.96 2k39 h ILE 23 CO 0.53 0.00 -0.36 -0.08 -0.69 0.00 0.00 178.15 177.55 2k39 h GLU 24 N 0.00 0.00 0.00 2.37 4.81 -1.79 -2.26 114.58 117.71 2k39 h GLU 24 Ca 0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2k39 h GLU 24 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 2k39 h GLU 24 CO 0.00 0.35 -1.14 -0.97 -0.73 0.00 0.00 179.01 176.52 2k39 h ASN 25 N 0.00 0.00 -0.81 1.04 -1.24 -0.97 -3.08 115.58 110.51 2k39 h ASN 25 Ca -0.00 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.99 2k39 h ASN 25 Cb 1.27 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.28 2k39 h ASN 25 CO 0.05 0.21 0.43 0.58 -1.29 0.00 0.00 177.43 177.41 2k39 h VAL 26 N 0.00 1.24 0.00 2.57 2.07 -0.96 -0.53 116.25 120.64 2k39 h VAL 26 Ca -0.06 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 2k39 h VAL 26 Cb 1.21 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2k39 h VAL 26 CO 0.02 0.28 -0.03 0.11 0.02 0.00 0.00 177.57 177.96 2k39 h LYS 27 N 1.14 0.00 0.06 1.57 1.57 -1.38 -1.57 116.57 117.96 2k39 h LYS 27 Ca 0.29 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.79 2k39 h LYS 27 Cb 0.05 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.39 2k39 h LYS 27 CO -0.04 0.03 -1.09 0.00 -0.57 0.00 0.00 179.45 177.78 2k39 h ALA 28 N 1.97 0.06 0.00 3.86 0.00 -1.34 -0.61 119.26 123.20 2k39 h ALA 28 Ca -0.00 -0.72 -0.10 0.00 0.00 0.00 0.00 54.91 54.09 2k39 h ALA 28 Cb 0.48 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2k39 h ALA 28 CO 0.00 0.65 -0.49 0.87 0.00 0.00 0.00 179.25 180.28 2k39 h LYS 29 N 0.29 0.00 0.26 0.00 1.57 -0.94 0.35 116.57 118.09 2k39 h LYS 29 Ca -0.15 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 2k39 h LYS 29 Cb 1.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.07 2k39 h LYS 29 CO 0.21 0.49 -0.12 0.82 -0.57 0.00 0.00 179.45 180.28 2k39 h ILE 30 N 0.00 0.00 -1.34 1.86 2.04 -1.39 -3.36 117.51 115.31 2k39 h ILE 30 Ca -0.00 -0.24 0.39 0.00 1.00 0.00 0.00 64.86 66.00 2k39 h ILE 30 Cb 0.95 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.96 2k39 h ILE 30 CO 0.06 0.00 0.95 -0.61 0.00 0.00 0.00 178.15 178.55 2k39 h GLN 31 N -0.59 0.06 -0.80 2.37 4.15 -0.37 -0.28 115.11 119.64 2k39 h GLN 31 Ca -0.04 -0.00 0.20 0.00 0.77 0.00 0.00 58.65 59.58 2k39 h GLN 31 Cb 0.27 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.90 2k39 h GLN 31 CO 0.06 0.04 0.55 0.22 -1.93 0.00 0.00 178.83 177.76 2k39 h ASP 32 N 0.06 0.22 0.00 -0.69 3.58 -0.48 0.03 116.42 119.15 2k39 h ASP 32 Ca 0.67 0.02 -0.07 0.00 0.42 0.00 0.00 57.03 58.07 2k39 h ASP 32 Cb 2.51 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 43.53 2k39 h ASP 32 CO -0.09 0.10 -1.27 1.17 -2.88 0.00 0.00 179.24 176.27 2k39 n LYS 33 N -4.42 0.38 0.04 0.28 4.81 -0.34 -4.84 118.16 114.07 2k39 n LYS 33 Ca 0.16 0.03 -0.09 0.00 -0.87 0.00 0.00 58.31 57.53 2k39 n LYS 33 Cb 0.72 -1.10 -0.13 0.00 0.02 0.00 0.00 35.03 34.54 2k39 n LYS 33 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2k39 h GLU 34 N 0.00 0.05 0.00 1.64 4.39 -0.83 -3.48 114.58 116.35 2k39 h GLU 34 Ca -0.11 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.50 2k39 h GLU 34 Cb 1.17 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 2k39 h GLU 34 CO -0.02 0.89 0.00 0.41 -1.16 0.00 0.00 179.01 179.13 2k39 n GLY 35 N 1.47 1.35 3.72 -3.84 0.00 -0.03 -4.69 105.19 103.16 2k39 n GLY 35 Ca -0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.75 5.35 0.69 -0.61 1.01 -1.26 -4.43 121.20 119.20 2k39 s ILE 36 Ca 0.00 0.36 -0.14 0.00 0.00 0.00 0.00 60.65 60.86 2k39 s ILE 36 Cb 0.00 -3.55 0.02 0.00 0.01 0.00 0.00 42.46 38.93 2k39 s ILE 36 CO 0.00 0.40 1.12 -2.16 0.00 0.00 0.00 174.94 174.30 2k39 s PRO 37 N 0.56 2.59 0.45 2.79 0.04 -1.26 -4.41 135.00 135.76 2k39 s PRO 37 Ca 0.12 1.41 0.32 0.00 0.04 0.00 0.00 61.00 62.89 2k39 s PRO 37 Cb -0.12 -1.92 1.45 0.00 0.04 0.00 0.00 34.50 33.94 2k39 s PRO 37 CO 0.02 -1.42 1.63 -1.35 0.04 0.00 0.00 177.00 175.92 2k39 h PRO 38 N -0.22 0.08 -0.98 0.56 0.11 -1.93 -2.24 132.00 127.38 2k39 h PRO 38 Ca -0.46 -0.00 0.33 0.00 0.11 0.00 0.00 66.00 65.97 2k39 h PRO 38 Cb 1.25 -0.02 -0.16 0.00 0.11 0.00 0.00 31.00 32.18 2k39 h PRO 38 CO 0.53 0.05 0.47 0.22 -0.21 0.00 0.00 178.00 179.06 2k39 h ASP 39 N 0.08 0.30 0.10 -2.05 3.58 -1.97 -2.81 116.42 113.65 2k39 h ASP 39 Ca 0.82 0.22 0.00 0.00 0.42 0.00 0.00 57.03 58.49 2k39 h ASP 39 Cb 2.65 0.22 0.00 0.00 1.72 0.00 0.00 39.33 43.92 2k39 h ASP 39 CO -0.37 -0.24 -0.53 0.00 -2.88 0.00 0.00 179.24 175.21 2k39 n GLN 40 N -5.17 0.75 -3.71 0.28 6.02 -0.84 -4.79 117.38 109.92 2k39 n GLN 40 Ca 0.31 -0.57 -0.37 0.00 -0.01 0.00 0.00 57.00 56.37 2k39 n GLN 40 Cb 1.01 -1.49 -0.11 0.00 1.02 0.00 0.00 30.24 30.67 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 -2.64 3.92 -0.09 -1.09 -0.21 -1.06 -1.98 119.66 116.50 2k39 s GLN 41 Ca 0.17 -0.35 0.04 0.00 0.02 0.00 0.00 55.36 55.25 2k39 s GLN 41 Cb 0.18 -3.48 -0.00 0.00 1.00 0.00 0.00 33.01 30.71 2k39 s GLN 41 CO 0.63 -0.05 -0.24 1.03 -2.12 0.00 0.00 175.29 174.55 2k39 s ARG 42 N 1.32 2.84 -0.11 2.91 0.52 0.00 -4.95 118.95 121.48 2k39 s ARG 42 Ca 0.06 -0.86 0.03 0.00 -0.52 0.00 0.00 55.73 54.44 2k39 s ARG 42 Cb -0.15 -2.21 -0.00 0.00 0.52 0.00 0.00 34.95 33.11 2k39 s ARG 42 CO 0.06 0.22 -0.21 -0.51 0.02 0.00 0.00 175.30 174.88 2k39 s LEU 43 N 0.22 2.22 0.10 2.53 1.43 -1.26 0.05 118.68 123.97 2k39 s LEU 43 Ca -0.15 -0.52 0.09 0.00 -1.03 0.00 0.00 54.13 52.53 2k39 s LEU 43 Cb -0.17 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.56 2k39 s LEU 43 CO 0.07 0.15 -0.23 -0.63 0.23 0.00 0.00 176.35 175.94 2k39 s ILE 44 N 0.43 2.48 -0.12 -0.59 1.09 -0.66 -2.69 121.20 121.14 2k39 s ILE 44 Ca -0.15 -1.53 -0.04 0.00 -1.10 0.00 0.00 60.65 57.83 2k39 s ILE 44 Cb -0.17 -2.08 0.05 0.00 -1.06 0.00 0.00 42.46 39.20 2k39 s ILE 44 CO 0.06 0.18 0.11 0.12 -0.10 0.00 0.00 174.94 175.31 2k39 s PHE 45 N -1.02 0.05 -1.22 3.97 5.36 -0.51 -0.80 117.98 123.81 2k39 s PHE 45 Ca 0.15 0.04 -0.07 0.00 -0.96 0.00 0.00 56.93 56.09 2k39 s PHE 45 Cb -0.10 -0.53 0.01 0.00 -0.34 0.00 0.00 43.02 42.05 2k39 s PHE 45 CO 0.06 -0.40 1.06 0.00 -1.46 0.00 0.00 175.22 174.49 2k39 n ALA 46 N 5.30 -1.29 0.00 11.12 0.00 -1.26 -2.46 120.51 131.92 2k39 n ALA 46 Ca -0.05 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.70 2k39 n ALA 46 Cb 0.49 -4.72 0.00 0.00 0.00 0.00 0.00 19.45 15.22 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 -1.78 2.86 3.71 0.00 0.00 -1.26 -5.01 105.19 103.71 2k39 n GLY 47 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.24 4.27 -1.01 1.61 1.02 -1.03 -5.00 119.74 119.36 2k39 s LYS 48 Ca 0.00 0.22 -0.18 0.00 0.02 0.00 0.00 55.97 56.03 2k39 s LYS 48 Cb 0.00 -3.45 0.13 0.00 -0.52 0.00 0.00 37.83 33.99 2k39 s LYS 48 CO 0.00 0.16 1.24 -1.14 -0.92 0.00 0.00 175.35 174.69 2k39 s GLN 49 N 0.67 3.72 0.23 1.68 0.74 -1.26 -1.42 119.66 124.02 2k39 s GLN 49 Ca 0.20 -1.91 -0.31 0.00 0.05 0.00 0.00 55.36 53.40 2k39 s GLN 49 Cb -0.14 -5.00 -0.15 0.00 1.10 0.00 0.00 33.01 28.82 2k39 s GLN 49 CO 0.07 -1.82 1.15 1.28 -0.55 0.00 0.00 175.29 175.41 2k39 n LEU 50 N 6.58 1.89 -4.63 3.68 4.77 -1.10 -4.94 117.00 123.26 2k39 n LEU 50 Ca 0.28 1.16 -0.43 0.00 -0.03 0.00 0.00 56.01 56.99 2k39 n LEU 50 Cb 0.48 -1.28 -0.03 0.00 -2.33 0.00 0.00 43.42 40.26 2k39 n LEU 50 CO 0.55 -1.20 1.55 -0.70 -1.33 0.00 0.00 177.39 176.26 2k39 s GLU 51 N -0.81 3.67 0.00 3.23 2.12 -1.26 -4.89 118.70 120.77 2k39 s GLU 51 Ca 0.67 1.95 0.10 0.00 0.36 0.00 0.00 54.97 58.05 2k39 s GLU 51 Cb -0.76 -4.16 0.54 0.00 0.26 0.00 0.00 34.13 30.01 2k39 s GLU 51 CO 0.55 -1.46 1.18 -0.25 -0.54 0.00 0.00 175.26 174.74 2k39 n ASP 52 N 9.18 0.00 -0.09 -1.70 9.92 -1.26 -1.06 116.55 131.54 2k39 n ASP 52 Ca 0.22 0.04 0.01 0.00 -0.53 0.00 0.00 54.79 54.53 2k39 n ASP 52 Cb 0.44 -0.23 0.01 0.00 -0.64 0.00 0.00 41.12 40.71 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 -0.40 -1.25 3.94 0.44 0.00 -1.26 -2.63 105.19 104.02 2k39 n GLY 53 Ca 0.05 -0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.19 3.49 0.44 1.61 1.81 -0.23 -4.97 118.95 120.90 2k39 s ARG 54 Ca 0.03 -0.25 0.07 0.00 -1.72 0.00 0.00 55.73 53.86 2k39 s ARG 54 Cb 0.02 -2.62 -0.01 0.00 -0.45 0.00 0.00 34.95 31.89 2k39 s ARG 54 CO 0.03 0.09 0.39 0.95 -0.68 0.00 0.00 175.30 176.07 2k39 s THR 55 N -2.39 2.51 0.23 0.02 -4.23 -1.26 -2.46 115.64 108.07 2k39 s THR 55 Ca 0.41 -1.36 0.08 0.00 -1.18 0.00 0.00 61.69 59.64 2k39 s THR 55 Cb -0.10 -2.88 -0.07 0.00 1.34 0.00 0.00 72.50 70.79 2k39 s THR 55 CO 0.37 0.00 1.52 -0.07 -0.54 0.00 0.00 174.62 175.91 2k39 h LEU 56 N 0.99 0.05 -1.06 4.79 3.38 -1.62 -3.05 115.31 118.80 2k39 h LEU 56 Ca -0.41 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.44 2k39 h LEU 56 Cb 1.27 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 2k39 h LEU 56 CO 0.57 0.74 -0.27 -1.28 0.09 0.00 0.00 178.44 178.30 2k39 h SER 57 N 0.03 0.34 1.01 -0.43 0.87 -1.84 -1.82 113.55 111.72 2k39 h SER 57 Ca -0.01 -0.11 -0.04 0.00 -1.23 0.00 0.00 61.79 60.40 2k39 h SER 57 Cb 1.26 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 63.12 2k39 h SER 57 CO 0.10 0.61 -0.18 0.44 -0.53 0.00 0.00 176.83 177.27 2k39 h ASP 58 N 0.31 0.00 0.15 6.23 3.32 -1.86 -2.64 116.42 121.93 2k39 h ASP 58 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2k39 h ASP 58 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 2k39 h ASP 58 CO 0.05 0.18 -0.22 -1.22 -1.72 0.00 0.00 179.24 176.31 2k39 n TYR 59 N -3.31 0.00 -3.23 4.55 4.01 -1.20 -4.98 117.16 112.99 2k39 n TYR 59 Ca 0.00 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.51 2k39 n TYR 59 Cb 0.42 -0.08 0.04 0.00 -0.31 0.00 0.00 39.34 39.41 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 -0.35 -5.95 -4.69 7.72 5.15 -0.99 -4.96 115.26 111.19 2k39 n ASN 60 Ca 0.13 -0.38 -0.42 0.00 -0.60 0.00 0.00 54.58 53.31 2k39 n ASN 60 Cb 0.37 -4.78 -0.03 0.00 -0.53 0.00 0.00 39.78 34.82 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 -3.20 4.44 0.56 -1.44 1.01 -0.70 -5.03 121.20 116.85 2k39 s ILE 61 Ca 0.40 1.75 0.07 0.00 0.00 0.00 0.00 60.65 62.87 2k39 s ILE 61 Cb -0.18 -4.12 0.07 0.00 0.01 0.00 0.00 42.46 38.24 2k39 s ILE 61 CO 0.49 0.00 0.77 -1.10 0.00 0.00 0.00 174.94 175.11 2k39 s GLN 62 N 2.13 2.34 -0.08 2.79 -1.52 -1.26 -4.81 119.66 119.24 2k39 s GLN 62 Ca 0.53 -1.44 -0.31 0.00 -1.95 0.00 0.00 55.36 52.19 2k39 s GLN 62 Cb -0.22 -2.62 -0.09 0.00 -0.22 0.00 0.00 33.01 29.86 2k39 s GLN 62 CO 0.20 -0.82 2.02 1.17 -0.25 0.00 0.00 175.29 177.62 2k39 n LYS 63 N -2.25 2.35 -2.98 2.91 4.81 -1.26 -3.56 118.16 118.17 2k39 n LYS 63 Ca 0.14 0.81 -0.12 0.00 -0.87 0.00 0.00 58.31 58.27 2k39 n LYS 63 Cb 0.61 -2.92 0.05 0.00 0.02 0.00 0.00 35.03 32.78 2k39 n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2k39 n GLU 64 N 7.62 -4.16 -3.97 1.64 1.02 -0.86 -5.06 120.64 116.88 2k39 n GLU 64 Ca 0.25 0.47 -0.23 0.00 -0.02 0.00 0.00 57.16 57.62 2k39 n GLU 64 Cb 0.37 -4.40 -0.03 0.00 -0.02 0.00 0.00 31.44 27.37 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2k39 s SER 65 N -3.43 6.29 -0.19 1.62 1.04 -1.23 -4.91 113.70 112.89 2k39 s SER 65 Ca 0.19 0.10 -0.06 0.00 0.48 0.00 0.00 55.95 56.66 2k39 s SER 65 Cb -0.08 -1.86 -0.03 0.00 0.10 0.00 0.00 66.02 64.14 2k39 s SER 65 CO 0.41 -0.01 0.02 -0.89 0.98 0.00 0.00 173.24 173.75 2k39 s THR 66 N -1.88 4.26 0.65 2.02 2.01 -1.26 -2.82 115.64 118.62 2k39 s THR 66 Ca 0.34 -0.21 -0.02 0.00 0.31 0.00 0.00 61.69 62.11 2k39 s THR 66 Cb -0.10 -2.92 0.07 0.00 0.01 0.00 0.00 72.50 69.56 2k39 s THR 66 CO 0.29 0.44 0.92 -0.76 -0.69 0.00 0.00 174.62 174.81 2k39 s LEU 67 N 0.73 3.05 -0.02 4.42 1.02 -0.59 -4.78 118.68 122.50 2k39 s LEU 67 Ca 0.01 0.02 0.02 0.00 0.02 0.00 0.00 54.13 54.21 2k39 s LEU 67 Cb -0.14 -2.67 0.00 0.00 0.02 0.00 0.00 46.19 43.41 2k39 s LEU 67 CO 0.02 -1.52 -0.07 -1.00 0.02 0.00 0.00 176.35 173.80 2k39 s HIS 68 N -3.03 0.77 -0.25 0.29 3.76 0.02 -1.04 115.29 115.81 2k39 s HIS 68 Ca 0.61 -0.17 0.00 0.00 -0.15 0.00 0.00 55.06 55.35 2k39 s HIS 68 Cb -0.09 -0.55 0.07 0.00 1.11 0.00 0.00 32.58 33.12 2k39 s HIS 68 CO 0.42 -0.07 -0.02 -1.17 -0.85 0.00 0.00 174.74 173.05 2k39 s LEU 69 N 0.15 2.52 -0.32 0.89 2.96 0.23 -1.66 118.68 123.46 2k39 s LEU 69 Ca -0.02 -1.26 -0.25 0.00 -0.22 0.00 0.00 54.13 52.39 2k39 s LEU 69 Cb -0.07 -1.10 0.00 0.00 0.50 0.00 0.00 46.19 45.52 2k39 s LEU 69 CO 0.00 -0.28 0.85 -0.69 -1.32 0.00 0.00 176.35 174.91 2k39 s VAL 70 N 1.44 4.73 0.16 1.68 1.01 0.11 -3.64 120.40 125.88 2k39 s VAL 70 Ca -0.02 1.26 0.04 0.00 0.00 0.00 0.00 61.98 63.26 2k39 s VAL 70 Cb -0.18 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 2k39 s VAL 70 CO -0.09 -0.32 0.18 -0.76 0.00 0.00 0.00 175.10 174.12 2k39 s LEU 71 N 3.11 3.97 -1.20 3.92 2.01 -1.26 -0.82 118.68 128.42 2k39 s LEU 71 Ca 0.35 -0.03 -0.06 0.00 0.01 0.00 0.00 54.13 54.40 2k39 s LEU 71 Cb -0.14 -2.57 0.22 0.00 0.01 0.00 0.00 46.19 43.71 2k39 s LEU 71 CO 0.14 0.07 1.84 -1.14 1.01 0.00 0.00 176.35 178.26 2k39 n ARG 72 N -0.39 4.30 -1.55 1.70 0.63 -0.84 -4.99 116.66 115.52 2k39 n ARG 72 Ca -0.08 -3.98 -0.23 0.00 -0.92 0.00 0.00 57.85 52.65 2k39 n ARG 72 Cb 0.54 -2.69 -0.07 0.00 0.45 0.00 0.00 32.46 30.70 2k39 n ARG 72 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 2k39 n LEU 73 N 2.19 1.73 0.00 6.15 -0.00 -1.26 -4.50 117.00 121.31 2k39 n LEU 73 Ca 0.40 -1.02 0.00 0.00 -0.00 0.00 0.00 56.01 55.39 2k39 n LEU 73 Cb 0.32 -1.54 0.00 0.00 -0.00 0.00 0.00 43.42 42.20 2k39 n LEU 73 CO 0.73 -2.12 0.00 -1.14 -0.00 0.00 0.00 177.39 174.86 2k39 n ARG 74 N 8.67 0.00 0.00 1.47 3.00 -1.26 -5.18 116.66 123.35 2k39 n ARG 74 Ca 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.31 2k39 n ARG 74 Cb 0.44 -0.40 0.00 0.00 0.00 0.00 0.00 32.46 32.50 2k39 n ARG 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k39 n GLY 75 N 0.49 0.82 0.19 5.14 0.00 -1.26 -5.21 105.19 105.36 2k39 n GLY 75 Ca 0.00 -2.18 0.02 0.00 0.00 0.00 0.00 46.02 43.86 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93