#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k40 n ARG 2 N 0.00 0.75 -1.13 1.61 1.74 -1.26 -5.07 116.66 113.30 2k40 n ARG 2 Ca 0.00 -0.20 0.15 0.00 -0.77 0.00 0.00 57.85 57.03 2k40 n ARG 2 Cb 0.00 -0.03 -0.05 0.00 -1.02 0.00 0.00 32.46 31.35 2k40 n ARG 2 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2k40 n ARG 3 N -1.11 -2.47 -1.47 5.56 1.74 -1.26 -4.93 116.66 112.72 2k40 n ARG 3 Ca 0.01 1.85 -0.30 0.00 -0.77 0.00 0.00 57.85 58.65 2k40 n ARG 3 Cb 0.04 -2.94 0.21 0.00 -1.02 0.00 0.00 32.46 28.75 2k40 n ARG 3 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2k40 s PRO 4 N -3.05 -0.19 -0.45 5.56 0.04 -1.26 -4.96 135.00 130.69 2k40 s PRO 4 Ca 0.00 -0.15 -0.43 0.00 0.04 0.00 0.00 61.00 60.46 2k40 s PRO 4 Cb 0.00 -1.72 -0.18 0.00 0.04 0.00 0.00 34.50 32.64 2k40 s PRO 4 CO 0.00 -3.01 1.97 -2.13 0.04 0.00 0.00 177.00 173.86 2k40 n ARG 5 N -4.25 0.33 -3.48 4.56 0.00 -1.26 -4.94 116.66 107.62 2k40 n ARG 5 Ca 0.13 0.10 -0.24 0.00 -0.00 0.00 0.00 57.85 57.84 2k40 n ARG 5 Cb 0.59 -1.74 -0.02 0.00 0.00 0.00 0.00 32.46 31.30 2k40 n ARG 5 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2k40 s THR 6 N 5.16 5.13 0.23 5.15 2.01 -1.26 -5.14 115.64 126.93 2k40 s THR 6 Ca 1.12 -0.46 -0.04 0.00 0.31 0.00 0.00 61.69 62.62 2k40 s THR 6 Cb -1.34 -3.83 -0.03 0.00 0.01 0.00 0.00 72.50 67.31 2k40 s THR 6 CO 0.67 -0.46 0.26 0.00 -0.69 0.00 0.00 174.62 174.40 2k40 s ALA 7 N -2.20 0.81 0.00 7.40 0.00 -1.26 -4.92 121.76 121.60 2k40 s ALA 7 Ca 0.39 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 50.86 2k40 s ALA 7 Cb -0.10 1.29 -0.00 0.00 0.00 0.00 0.00 23.12 24.31 2k40 s ALA 7 CO 0.34 -0.68 0.00 1.19 0.00 0.00 0.00 175.76 176.60 2k40 n PHE 8 N -0.35 -0.00 -2.47 0.00 3.72 -1.26 -5.15 117.46 111.96 2k40 n PHE 8 Ca 0.01 -0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.05 2k40 n PHE 8 Cb 0.64 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.15 2k40 n PHE 8 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 2k40 s THR 9 N -1.77 3.56 0.49 4.37 -1.32 -1.26 -4.91 115.64 114.80 2k40 s THR 9 Ca 0.00 1.18 0.18 0.00 -1.21 0.00 0.00 61.69 61.84 2k40 s THR 9 Cb 0.00 -3.60 0.33 0.00 -1.51 0.00 0.00 72.50 67.72 2k40 s THR 9 CO 0.00 -0.00 2.03 -0.61 -2.21 0.00 0.00 174.62 173.83 2k40 h GLN 10 N 2.36 0.18 0.00 7.08 4.15 -2.01 0.39 115.11 127.26 2k40 h GLN 10 Ca -0.49 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 58.90 2k40 h GLN 10 Cb 1.22 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.87 2k40 h GLN 10 CO 0.62 0.12 -0.10 -0.97 -1.93 0.00 0.00 178.83 176.57 2k40 h ASN 11 N 0.18 0.00 0.10 -0.69 -0.00 -2.00 -0.33 115.58 112.84 2k40 h ASN 11 Ca 0.20 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.49 2k40 h ASN 11 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.86 2k40 h ASN 11 CO -0.03 0.10 -0.05 -0.61 -0.00 0.00 0.00 177.43 176.84 2k40 h GLN 12 N 0.00 -0.13 -0.55 6.67 5.75 -1.35 -3.36 115.11 122.14 2k40 h GLN 12 Ca -0.00 0.01 0.11 0.00 -0.15 0.00 0.00 58.65 58.62 2k40 h GLN 12 Cb 0.56 0.03 -0.11 0.00 1.07 0.00 0.00 27.48 29.03 2k40 h GLN 12 CO 0.01 0.37 -0.16 0.82 -2.65 0.00 0.00 178.83 177.22 2k40 h ILE 13 N -0.90 0.41 -0.04 2.39 1.08 -0.87 0.04 117.51 119.61 2k40 h ILE 13 Ca -0.01 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.47 2k40 h ILE 13 Cb 0.55 0.41 -0.00 0.00 -3.07 0.00 0.00 36.82 34.71 2k40 h ILE 13 CO 0.02 0.00 0.04 -0.33 -0.69 0.00 0.00 178.15 177.19 2k40 h GLU 14 N -0.03 0.00 0.16 2.37 4.39 -1.26 0.11 114.58 120.32 2k40 h GLU 14 Ca 0.26 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.95 2k40 h GLU 14 Cb 0.43 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 2k40 h GLU 14 CO -0.58 0.00 -0.07 0.28 -1.16 0.00 0.00 179.01 177.48 2k40 h VAL 15 N 0.00 0.95 -0.40 3.13 2.07 -1.13 -0.50 116.25 120.37 2k40 h VAL 15 Ca 0.02 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.07 2k40 h VAL 15 Cb 0.10 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 2k40 h VAL 15 CO -0.00 0.11 0.26 -0.07 0.02 0.00 0.00 177.57 177.89 2k40 h LEU 16 N -0.44 0.45 -0.42 2.57 -0.00 -1.28 -2.34 115.31 113.84 2k40 h LEU 16 Ca -0.02 -0.01 0.08 0.00 -0.00 0.00 0.00 57.88 57.93 2k40 h LEU 16 Cb 0.34 -0.11 -0.07 0.00 -0.00 0.00 0.00 40.66 40.82 2k40 h LEU 16 CO 0.04 0.32 -0.02 -0.33 -0.00 0.00 0.00 178.44 178.45 2k40 h GLU 17 N 0.53 0.08 0.00 1.13 4.39 -0.83 0.65 114.58 120.52 2k40 h GLU 17 Ca 0.15 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.84 2k40 h GLU 17 Cb -0.05 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2k40 h GLU 17 CO -0.04 0.05 0.00 -0.91 -1.16 0.00 0.00 179.01 176.96 2k40 h ASN 18 N 0.08 0.00 0.00 1.42 2.35 -0.76 0.81 115.58 119.48 2k40 h ASN 18 Ca 0.21 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.88 2k40 h ASN 18 Cb 0.31 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 2k40 h ASN 18 CO -0.37 0.00 -0.44 0.58 -1.65 0.00 0.00 177.43 175.55 2k40 h VAL 19 N 0.00 1.49 -0.94 2.81 2.07 -0.82 -3.39 116.25 117.47 2k40 h VAL 19 Ca 0.00 -2.28 0.11 0.00 0.82 0.00 0.00 66.70 65.34 2k40 h VAL 19 Cb 0.22 2.98 -0.07 0.00 -1.52 0.00 0.00 31.29 32.89 2k40 h VAL 19 CO 0.00 0.50 0.60 0.15 0.02 0.00 0.00 177.57 178.85 2k40 h PHE 20 N -1.00 1.03 0.00 1.57 3.57 0.04 0.21 116.94 122.37 2k40 h PHE 20 Ca -0.12 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.41 2k40 h PHE 20 Cb 1.10 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.51 2k40 h PHE 20 CO 0.22 0.45 0.00 2.89 -2.23 0.00 0.00 178.31 179.64 2k40 n ARG 21 N -4.56 0.11 -0.01 1.11 1.85 0.19 -2.90 116.66 112.45 2k40 n ARG 21 Ca 0.17 0.21 -0.01 0.00 -1.00 0.00 0.00 57.85 57.22 2k40 n ARG 21 Cb 0.33 -1.50 -0.01 0.00 -1.05 0.00 0.00 32.46 30.23 2k40 n ARG 21 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2k40 n VAL 22 N -1.37 0.07 -3.50 8.89 0.31 -0.41 -4.95 118.33 117.37 2k40 n VAL 22 Ca 0.05 -0.03 -0.29 0.00 -0.01 0.00 0.00 64.34 64.05 2k40 n VAL 22 Cb 0.12 -0.75 -0.13 0.00 -0.91 0.00 0.00 33.84 32.17 2k40 n VAL 22 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2k40 s ASN 23 N -3.64 3.20 0.58 4.52 0.01 0.61 -5.03 114.94 115.20 2k40 s ASN 23 Ca -0.01 -1.84 0.27 0.00 -0.71 0.00 0.00 52.86 50.56 2k40 s ASN 23 Cb 0.00 -0.39 1.67 0.00 0.41 0.00 0.00 41.25 42.94 2k40 s ASN 23 CO 0.03 -0.36 2.19 0.00 -1.51 0.00 0.00 177.10 177.45 2k40 s TYR 25 N -4.73 0.15 1.02 0.00 2.02 -1.26 -4.92 117.35 109.63 2k40 s TYR 25 Ca -0.05 -0.44 -0.17 0.00 -0.37 0.00 0.00 57.07 56.03 2k40 s TYR 25 Cb 0.16 -0.72 0.24 0.00 -0.40 0.00 0.00 41.96 41.24 2k40 s TYR 25 CO 0.58 -0.65 1.31 -0.35 -1.57 0.00 0.00 175.55 174.86 2k40 n PRO 26 N 5.28 -1.55 -1.47 -1.71 -0.04 -1.24 -5.09 135.00 129.18 2k40 n PRO 26 Ca -0.06 -2.02 -0.29 0.00 -0.04 0.00 0.00 63.50 61.08 2k40 n PRO 26 Cb 0.47 -1.41 0.13 0.00 -0.04 0.00 0.00 33.50 32.64 2k40 n PRO 26 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k40 s GLY 27 N -5.73 1.59 0.21 0.55 0.00 -1.26 -4.90 107.32 97.77 2k40 s GLY 27 Ca 0.75 -0.36 -0.09 0.00 0.00 0.00 0.00 44.72 45.02 2k40 s GLY 27 CO 0.53 0.16 1.82 -2.22 0.00 0.00 0.00 173.10 173.39 2k40 h ILE 28 N -1.42 1.23 -0.23 0.90 1.08 -1.99 -2.04 117.51 115.03 2k40 h ILE 28 Ca -0.50 -0.58 0.04 0.00 -0.39 0.00 0.00 64.86 63.43 2k40 h ILE 28 Cb 1.31 0.22 -0.01 0.00 -3.07 0.00 0.00 36.82 35.27 2k40 h ILE 28 CO 0.60 0.26 0.16 0.44 -0.69 0.00 0.00 178.15 178.92 2k40 h ASP 29 N 1.06 0.11 0.14 1.72 5.19 -1.97 0.24 116.42 122.90 2k40 h ASP 29 Ca 0.27 -0.00 -0.27 0.00 -0.62 0.00 0.00 57.03 56.41 2k40 h ASP 29 Cb 0.04 -0.02 0.02 0.00 0.18 0.00 0.00 39.33 39.54 2k40 h ASP 29 CO -0.04 0.07 -1.08 0.40 -3.12 0.00 0.00 179.24 175.47 2k40 h ILE 30 N 0.13 1.32 -0.47 0.35 1.08 -1.76 0.14 117.51 118.29 2k40 h ILE 30 Ca 0.10 -2.38 -0.02 0.00 -0.39 0.00 0.00 64.86 62.18 2k40 h ILE 30 Cb 0.26 2.49 -0.02 0.00 -3.07 0.00 0.00 36.82 36.47 2k40 h ILE 30 CO -0.01 0.72 0.24 -0.07 -0.69 0.00 0.00 178.15 178.34 2k40 h LEU 31 N 0.32 0.61 -0.58 1.44 3.38 -0.80 -0.21 115.31 119.47 2k40 h LEU 31 Ca -0.13 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 2k40 h LEU 31 Cb 1.73 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.31 2k40 h LEU 31 CO 0.20 0.56 0.09 -0.33 0.09 0.00 0.00 178.44 179.05 2k40 h GLU 32 N 0.62 0.97 -0.46 1.13 5.08 -0.61 0.42 114.58 121.72 2k40 h GLU 32 Ca 0.16 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 2k40 h GLU 32 Cb 0.10 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2k40 h GLU 32 CO -0.02 0.92 0.11 0.22 -1.00 0.00 0.00 179.01 179.24 2k40 h ASP 33 N 0.87 0.71 -0.74 1.42 3.58 -0.67 -0.66 116.42 120.92 2k40 h ASP 33 Ca 0.18 -0.24 -0.01 0.00 0.42 0.00 0.00 57.03 57.38 2k40 h ASP 33 Cb 0.43 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 41.26 2k40 h ASP 33 CO 0.01 0.76 0.43 -0.07 -2.88 0.00 0.00 179.24 177.49 2k40 h LEU 34 N 0.62 0.91 0.49 2.28 3.38 -0.98 0.15 115.31 122.17 2k40 h LEU 34 Ca 0.15 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2k40 h LEU 34 Cb 0.33 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2k40 h LEU 34 CO 0.00 0.73 -0.45 0.00 0.09 0.00 0.00 178.44 178.81 2k40 h ALA 35 N 1.22 -1.02 -0.50 1.53 0.00 -0.72 -0.47 119.26 119.30 2k40 h ALA 35 Ca 0.26 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2k40 h ALA 35 Cb 0.00 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2k40 h ALA 35 CO -0.05 -1.11 0.02 -0.56 0.00 0.00 0.00 179.25 177.56 2k40 h GLN 36 N -0.94 0.82 -0.28 0.00 -0.00 -1.04 -0.49 115.11 113.18 2k40 h GLN 36 Ca -0.05 -0.21 -0.14 0.00 -0.00 0.00 0.00 58.65 58.24 2k40 h GLN 36 Cb 0.81 -0.10 -0.00 0.00 -0.00 0.00 0.00 27.48 28.19 2k40 h GLN 36 CO -0.04 0.81 -0.37 0.87 -0.00 0.00 0.00 178.83 180.10 2k40 h LYS 37 N 0.77 0.75 -0.01 0.06 1.57 -0.91 -3.21 116.57 115.58 2k40 h LYS 37 Ca 0.15 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2k40 h LYS 37 Cb 0.43 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2k40 h LYS 37 CO 0.02 1.05 -0.10 1.28 -0.57 0.00 0.00 179.45 181.13 2k40 n LEU 38 N -4.19 1.42 -3.93 2.94 4.77 -0.19 -4.98 117.00 112.85 2k40 n LEU 38 Ca -0.04 -0.45 -0.25 0.00 -0.03 0.00 0.00 56.01 55.24 2k40 n LEU 38 Cb 0.52 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.55 2k40 n LEU 38 CO 0.47 0.25 -0.22 -3.20 -1.33 0.00 0.00 177.39 173.35 2k40 n ASN 39 N -0.06 -0.59 -4.86 -1.43 2.85 -0.34 -5.04 115.26 105.80 2k40 n ASN 39 Ca 0.16 -1.00 -0.22 0.00 -0.11 0.00 0.00 54.58 53.41 2k40 n ASN 39 Cb 0.37 -3.12 -0.03 0.00 1.24 0.00 0.00 39.78 38.23 2k40 n ASN 39 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2k40 s LEU 40 N -6.93 3.20 -0.01 1.20 1.43 -0.37 -5.03 118.68 112.18 2k40 s LEU 40 Ca 0.02 -0.91 -0.14 0.00 -1.03 0.00 0.00 54.13 52.08 2k40 s LEU 40 Cb -0.01 -1.76 -0.06 0.00 0.03 0.00 0.00 46.19 44.39 2k40 s LEU 40 CO 0.88 -0.74 0.38 -1.83 0.23 0.00 0.00 176.35 175.28 2k40 s GLU 41 N -4.13 3.87 0.38 1.70 1.03 -1.26 -4.41 118.70 115.88 2k40 s GLU 41 Ca 0.45 0.36 0.27 0.00 0.03 0.00 0.00 54.97 56.08 2k40 s GLU 41 Cb -0.02 -3.22 1.34 0.00 -0.80 0.00 0.00 34.13 31.43 2k40 s GLU 41 CO 0.26 0.70 1.81 1.37 -1.33 0.00 0.00 175.26 178.07 2k40 h LEU 42 N 4.72 0.00 -0.34 1.83 -0.00 -1.94 -1.17 115.31 118.42 2k40 h LEU 42 Ca -0.52 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.29 2k40 h LEU 42 Cb 1.22 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.87 2k40 h LEU 42 CO 0.61 0.00 -0.08 -0.78 -0.00 0.00 0.00 178.44 178.19 2k40 h ASP 43 N 0.00 0.66 -0.66 0.17 3.58 -1.96 0.21 116.42 118.42 2k40 h ASP 43 Ca 0.00 -0.36 -0.05 0.00 0.42 0.00 0.00 57.03 57.04 2k40 h ASP 43 Cb 0.14 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 40.98 2k40 h ASP 43 CO 0.00 0.87 0.24 0.03 -2.88 0.00 0.00 179.24 177.50 2k40 h ARG 44 N 0.45 1.03 -0.36 0.28 3.08 -1.58 -0.20 114.38 117.08 2k40 h ARG 44 Ca 0.09 -0.19 -0.13 0.00 0.07 0.00 0.00 59.98 59.81 2k40 h ARG 44 Cb 0.58 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 2k40 h ARG 44 CO 0.03 0.86 -0.30 0.82 -1.07 0.00 0.00 179.97 180.31 2k40 h ILE 45 N 1.00 1.28 -0.12 2.04 2.04 -1.40 0.35 117.51 122.71 2k40 h ILE 45 Ca 0.23 -1.47 0.04 0.00 1.00 0.00 0.00 64.86 64.66 2k40 h ILE 45 Cb 0.24 1.42 -0.05 0.00 -0.74 0.00 0.00 36.82 37.69 2k40 h ILE 45 CO -0.01 0.48 -0.20 1.56 0.00 0.00 0.00 178.15 179.98 2k40 h GLN 46 N 0.63 -0.24 -0.79 2.37 4.20 -0.38 0.08 115.11 120.98 2k40 h GLN 46 Ca 0.06 0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.83 2k40 h GLN 46 Cb 0.88 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.66 2k40 h GLN 46 CO 0.08 -0.16 0.49 0.82 -0.67 0.00 0.00 178.83 179.39 2k40 h ILE 47 N -0.25 1.08 0.10 2.54 5.03 -1.00 0.63 117.51 125.64 2k40 h ILE 47 Ca 0.10 -0.32 0.01 0.00 -0.12 0.00 0.00 64.86 64.53 2k40 h ILE 47 Cb 0.39 0.06 -0.02 0.00 -3.03 0.00 0.00 36.82 34.22 2k40 h ILE 47 CO -0.27 0.17 -0.18 -0.25 -0.68 0.00 0.00 178.15 176.94 2k40 h TRP 48 N 0.94 -0.47 -0.13 1.37 7.01 -0.23 0.83 115.95 125.27 2k40 h TRP 48 Ca 0.33 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.33 2k40 h TRP 48 Cb 0.07 0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.32 2k40 h TRP 48 CO -0.04 -0.26 0.07 0.74 -2.79 0.00 0.00 178.44 176.16 2k40 h PHE 49 N -0.34 0.18 -0.99 2.65 0.04 -0.81 -2.58 116.94 115.09 2k40 h PHE 49 Ca 0.03 -0.01 0.10 0.00 2.80 0.00 0.00 57.97 60.89 2k40 h PHE 49 Cb 0.36 -0.06 -0.08 0.00 2.20 0.00 0.00 35.95 38.38 2k40 h PHE 49 CO -0.18 0.20 0.63 1.96 -0.60 0.00 0.00 178.31 180.32 2k40 h GLN 50 N 0.11 1.00 -0.64 1.51 1.08 -0.76 0.63 115.11 118.03 2k40 h GLN 50 Ca 0.05 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 2k40 h GLN 50 Cb 0.08 -0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 27.26 2k40 h GLN 50 CO -0.01 0.66 0.36 -0.91 -0.95 0.00 0.00 178.83 177.99 2k40 h ASN 51 N 1.03 0.78 0.75 1.46 2.35 -0.60 0.11 115.58 121.46 2k40 h ASN 51 Ca 0.47 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 56.11 2k40 h ASN 51 Cb 0.40 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.57 2k40 h ASN 51 CO -0.23 0.64 -0.45 0.03 -1.65 0.00 0.00 177.43 175.77 2k40 h ARG 52 N 0.87 -1.08 -0.02 0.81 -0.00 -0.95 -2.08 114.38 111.93 2k40 h ARG 52 Ca 0.23 0.07 -0.04 0.00 -0.50 0.00 0.00 59.98 59.74 2k40 h ARG 52 Cb 0.02 0.24 -0.01 0.00 0.00 0.00 0.00 29.97 30.22 2k40 h ARG 52 CO -0.04 -0.72 -0.17 -0.09 0.00 0.00 0.00 179.97 178.95 2k40 h ARG 53 N -1.12 0.03 0.76 0.04 1.12 -0.77 0.35 114.38 114.79 2k40 h ARG 53 Ca -0.10 -0.01 -0.04 0.00 -1.11 0.00 0.00 59.98 58.73 2k40 h ARG 53 Cb 0.90 -0.00 0.01 0.00 -0.01 0.00 0.00 29.97 30.86 2k40 h ARG 53 CO 0.10 0.20 -0.36 0.00 -3.11 0.00 0.00 179.97 176.80 2k40 h ALA 54 N 1.80 -1.02 -0.38 2.80 0.00 -0.81 -3.20 119.26 118.45 2k40 h ALA 54 Ca 0.00 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.76 2k40 h ALA 54 Cb 0.33 0.39 -0.08 0.00 0.00 0.00 0.00 17.79 18.43 2k40 h ALA 54 CO 0.02 -1.03 -0.12 -0.22 0.00 0.00 0.00 179.25 177.91 2k40 h LYS 55 N -1.10 -0.03 0.00 0.00 3.11 -0.59 -1.47 116.57 116.49 2k40 h LYS 55 Ca -0.10 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.74 2k40 h LYS 55 Cb 0.80 0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.03 2k40 h LYS 55 CO 0.17 -0.02 0.05 -0.11 -2.81 0.00 0.00 179.45 176.73 2k40 n LEU 56 N -5.32 0.02 0.00 5.20 0.00 0.03 -1.26 117.00 115.68 2k40 n LEU 56 Ca 0.02 0.46 0.00 0.00 0.00 0.00 0.00 56.01 56.49 2k40 n LEU 56 Cb 0.23 -0.46 0.00 0.00 0.00 0.00 0.00 43.42 43.18 2k40 n LEU 56 CO 0.15 -0.47 0.36 2.29 0.00 0.00 0.00 177.39 179.72 2k40 n LYS 57 N -1.48 1.33 0.00 1.96 -0.00 -0.62 -5.04 118.16 114.31 2k40 n LYS 57 Ca -0.00 -0.98 0.00 0.00 -0.00 0.00 0.00 58.31 57.33 2k40 n LYS 57 Cb 0.05 -0.87 0.00 0.00 -0.00 0.00 0.00 35.03 34.21 2k40 n LYS 57 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2k40 n ARG 58 N -0.26 -0.28 -1.31 -1.58 0.63 -0.39 -4.90 116.66 108.57 2k40 n ARG 58 Ca 0.00 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.89 2k40 n ARG 58 Cb 0.24 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.16 2k40 n ARG 58 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2k40 n SER 59 N -2.78 -0.56 -3.26 6.15 7.64 -1.26 -4.64 113.62 114.90 2k40 n SER 59 Ca 0.00 -0.02 -0.27 0.00 1.01 0.00 0.00 58.87 59.59 2k40 n SER 59 Cb 0.00 -0.16 -0.02 0.00 -1.01 0.00 0.00 64.21 63.01 2k40 n SER 59 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2k40 n HIS 60 N -0.05 1.53 -3.05 1.43 8.25 -1.26 -4.48 115.22 117.59 2k40 n HIS 60 Ca -0.01 -2.00 -0.14 0.00 -0.26 0.00 0.00 57.72 55.31 2k40 n HIS 60 Cb 0.07 -1.72 -0.04 0.00 1.12 0.00 0.00 29.99 29.42 2k40 n HIS 60 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 2k40 s ARG 61 N 3.62 0.99 -0.04 -0.41 3.52 -1.26 -5.12 118.95 120.24 2k40 s ARG 61 Ca 0.44 -1.50 -0.29 0.00 -0.13 0.00 0.00 55.73 54.25 2k40 s ARG 61 Cb 0.11 -0.65 0.09 0.00 -1.56 0.00 0.00 34.95 32.94 2k40 s ARG 61 CO -0.01 -1.35 0.76 -2.00 -0.81 0.00 0.00 175.30 171.89 2k40 s GLU 62 N 0.55 0.96 -0.93 5.12 2.12 -1.26 -5.10 118.70 120.16 2k40 s GLU 62 Ca 0.31 0.06 -0.24 0.00 0.36 0.00 0.00 54.97 55.45 2k40 s GLU 62 Cb 0.01 0.45 -0.06 0.00 0.26 0.00 0.00 34.13 34.79 2k40 s GLU 62 CO -0.11 -0.34 1.98 -1.12 -0.54 0.00 0.00 175.26 175.13 2k40 s SER 63 N -1.55 5.00 0.03 -1.70 0.01 -1.26 -4.88 113.70 109.35 2k40 s SER 63 Ca -0.05 -0.76 -0.12 0.00 1.31 0.00 0.00 55.95 56.33 2k40 s SER 63 Cb -0.00 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.60 2k40 s SER 63 CO 0.02 -2.91 1.19 1.56 0.41 0.00 0.00 173.24 173.52 2k40 h GLN 64 N 11.19 -0.33 -2.50 12.44 4.20 -1.98 -3.44 115.11 134.69 2k40 h GLN 64 Ca 0.10 0.02 -0.31 0.00 0.06 0.00 0.00 58.65 58.53 2k40 h GLN 64 Cb 1.00 0.07 -0.36 0.00 0.30 0.00 0.00 27.48 28.49 2k40 h GLN 64 CO 1.19 -0.22 -0.62 -0.06 -0.67 0.00 0.00 178.83 178.46 2k40 s PHE 65 N -3.98 -0.30 -1.15 2.96 0.08 -1.26 -4.98 117.98 109.35 2k40 s PHE 65 Ca -0.06 0.25 -0.20 0.00 0.12 0.00 0.00 56.93 57.05 2k40 s PHE 65 Cb 0.02 -0.34 -0.01 0.00 -0.57 0.00 0.00 43.02 42.11 2k40 s PHE 65 CO 0.21 -0.61 0.79 1.28 -0.10 0.00 0.00 175.22 176.79 2k40 n LEU 66 N 5.32 -2.90 0.00 -0.37 4.77 -1.26 -5.30 117.00 117.26 2k40 n LEU 66 Ca -0.05 -1.01 0.00 0.00 -0.03 0.00 0.00 56.01 54.92 2k40 n LEU 66 Cb 0.50 -2.41 0.00 0.00 -2.33 0.00 0.00 43.42 39.17 2k40 n LEU 66 CO 0.08 0.46 0.08 0.80 -1.33 0.00 0.00 177.39 177.48