#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k40 h ARG 2 N 0.00 0.00 -2.04 1.61 2.43 -2.10 -3.33 114.38 110.95 2k40 h ARG 2 Ca 0.00 0.00 -0.50 0.00 -0.81 0.00 0.00 59.98 58.67 2k40 h ARG 2 Cb 0.00 0.00 -0.40 0.00 -0.42 0.00 0.00 29.97 29.15 2k40 h ARG 2 CO 0.00 0.00 -1.11 -2.13 -1.51 0.00 0.00 179.97 175.22 2k40 n ARG 3 N -2.35 1.25 -2.14 0.20 0.63 -1.26 -5.12 116.66 107.88 2k40 n ARG 3 Ca -0.01 -3.57 -0.42 0.00 -0.92 0.00 0.00 57.85 52.93 2k40 n ARG 3 Cb 0.08 -1.73 -0.03 0.00 0.45 0.00 0.00 32.46 31.22 2k40 n ARG 3 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2k40 s PRO 4 N -2.43 4.31 -1.17 -0.14 0.04 -1.25 -4.91 135.00 129.44 2k40 s PRO 4 Ca 0.41 2.12 -0.09 0.00 0.04 0.00 0.00 61.00 63.48 2k40 s PRO 4 Cb 0.32 -3.23 -0.14 0.00 0.04 0.00 0.00 34.50 31.50 2k40 s PRO 4 CO -0.09 -0.45 3.11 -2.13 0.04 0.00 0.00 177.00 177.48 2k40 n ARG 5 N 3.79 3.19 -1.78 4.56 0.63 -1.26 -4.91 116.66 120.89 2k40 n ARG 5 Ca 0.11 -1.85 -0.33 0.00 -0.92 0.00 0.00 57.85 54.86 2k40 n ARG 5 Cb 0.42 -2.57 -0.06 0.00 0.45 0.00 0.00 32.46 30.70 2k40 n ARG 5 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 2k40 n THR 6 N 3.31 1.91 -2.20 5.15 -1.04 -1.26 -4.93 114.28 115.22 2k40 n THR 6 Ca 0.68 -1.90 -0.26 0.00 -2.04 0.00 0.00 64.05 60.53 2k40 n THR 6 Cb 0.41 -2.22 0.09 0.00 -1.82 0.00 0.00 70.33 66.79 2k40 n THR 6 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2k40 s ALA 7 N 9.03 3.06 0.17 2.41 0.00 -1.26 -4.47 121.76 130.70 2k40 s ALA 7 Ca 0.65 -1.07 0.02 0.00 0.00 0.00 0.00 51.96 51.56 2k40 s ALA 7 Cb 0.04 -2.56 -0.01 0.00 0.00 0.00 0.00 23.12 20.59 2k40 s ALA 7 CO 0.13 -1.53 0.08 1.19 0.00 0.00 0.00 175.76 175.64 2k40 n PHE 8 N -3.07 -0.07 -2.45 0.00 3.72 -1.26 -5.14 117.46 109.19 2k40 n PHE 8 Ca 0.10 -1.20 -0.37 0.00 -0.05 0.00 0.00 57.45 55.93 2k40 n PHE 8 Cb 0.60 0.04 -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 -2.35 3.52 0.34 4.37 -1.32 -1.26 -4.80 115.64 114.14 2k40 s THR 9 Ca 0.12 1.17 0.06 0.00 -1.21 0.00 0.00 61.69 61.83 2k40 s THR 9 Cb 0.01 -3.60 0.30 0.00 -1.51 0.00 0.00 72.50 67.69 2k40 s THR 9 CO 0.08 0.01 1.90 -0.61 -2.21 0.00 0.00 174.62 173.80 2k40 h GLN 10 N 2.40 0.78 -0.11 7.08 4.15 -2.01 0.11 115.11 127.50 2k40 h GLN 10 Ca -0.49 -0.05 0.03 0.00 0.77 0.00 0.00 58.65 58.92 2k40 h GLN 10 Cb 1.22 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 28.73 2k40 h GLN 10 CO 0.62 0.51 0.09 -0.97 -1.93 0.00 0.00 178.83 177.16 2k40 h ASN 11 N 0.80 0.00 0.00 -0.69 -0.00 -2.00 0.23 115.58 113.92 2k40 h ASN 11 Ca 0.40 0.00 -0.06 0.00 -0.00 0.00 0.00 56.30 56.64 2k40 h ASN 11 Cb 0.46 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.77 2k40 h ASN 11 CO -0.17 0.00 -0.31 -0.61 -0.00 0.00 0.00 177.43 176.34 2k40 h GLN 12 N 0.00 0.01 -0.68 6.67 4.15 -1.41 -3.38 115.11 120.47 2k40 h GLN 12 Ca 0.05 -0.02 0.14 0.00 0.77 0.00 0.00 58.65 59.60 2k40 h GLN 12 Cb 0.24 0.01 -0.10 0.00 0.21 0.00 0.00 27.48 27.84 2k40 h GLN 12 CO -0.00 1.01 0.13 0.82 -1.93 0.00 0.00 178.83 178.85 2k40 h ILE 13 N -0.98 0.54 -0.03 2.39 1.08 -0.50 -1.85 117.51 118.16 2k40 h ILE 13 Ca -0.08 -0.08 0.01 0.00 -0.39 0.00 0.00 64.86 64.32 2k40 h ILE 13 Cb 1.09 0.29 -0.00 0.00 -3.07 0.00 0.00 36.82 35.13 2k40 h ILE 13 CO -0.04 0.04 0.03 -0.33 -0.69 0.00 0.00 178.15 177.16 2k40 h GLU 14 N 0.23 0.00 0.05 2.37 4.39 -1.17 0.23 114.58 120.69 2k40 h GLU 14 Ca 0.37 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.07 2k40 h GLU 14 Cb 0.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 2k40 h GLU 14 CO -0.49 0.00 -0.02 0.28 -1.16 0.00 0.00 179.01 177.62 2k40 h VAL 15 N 0.00 1.22 -0.45 3.13 2.07 -1.52 -1.71 116.25 119.00 2k40 h VAL 15 Ca 0.02 -0.96 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 2k40 h VAL 15 Cb 0.07 1.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 2k40 h VAL 15 CO -0.00 0.24 0.12 -0.07 0.02 0.00 0.00 177.57 177.87 2k40 h LEU 16 N -0.50 0.68 -0.89 2.57 4.07 -1.25 -2.27 115.31 117.73 2k40 h LEU 16 Ca -0.01 -0.23 0.07 0.00 0.08 0.00 0.00 57.88 57.80 2k40 h LEU 16 Cb 0.44 -0.18 -0.07 0.00 1.08 0.00 0.00 40.66 41.94 2k40 h LEU 16 CO 0.01 0.73 0.56 -0.33 -1.08 0.00 0.00 178.44 178.33 2k40 h GLU 17 N 0.60 0.96 -0.87 1.13 4.39 -0.68 0.76 114.58 120.87 2k40 h GLU 17 Ca 0.14 -0.06 0.05 0.00 0.34 0.00 0.00 59.36 59.83 2k40 h GLU 17 Cb 0.31 -0.22 -0.05 0.00 -0.10 0.00 0.00 28.75 28.69 2k40 h GLU 17 CO 0.00 0.63 0.57 -0.91 -1.16 0.00 0.00 179.01 178.15 2k40 h ASN 18 N 0.99 0.90 -0.15 1.42 2.35 -0.97 -0.76 115.58 119.36 2k40 h ASN 18 Ca 0.40 -0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 56.06 2k40 h ASN 18 Cb 0.23 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.40 2k40 h ASN 18 CO -0.19 0.60 -0.24 0.58 -1.65 0.00 0.00 177.43 176.53 2k40 h VAL 19 N 1.03 1.36 -0.10 2.81 2.07 -0.80 -3.30 116.25 119.33 2k40 h VAL 19 Ca 0.36 -1.47 0.03 0.00 0.82 0.00 0.00 66.70 66.43 2k40 h VAL 19 Cb 0.12 1.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.85 2k40 h VAL 19 CO -0.12 0.44 0.07 0.15 0.02 0.00 0.00 177.57 178.13 2k40 h PHE 20 N 0.03 0.01 0.28 1.57 3.57 -0.48 0.98 116.94 122.90 2k40 h PHE 20 Ca 0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2k40 h PHE 20 Cb 0.81 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.53 2k40 h PHE 20 CO 0.10 0.01 -0.27 0.00 -2.23 0.00 0.00 178.31 175.92 2k40 h ARG 21 N 0.01 -0.56 0.04 1.11 3.08 -1.22 -3.06 114.38 113.78 2k40 h ARG 21 Ca 0.05 0.04 -0.23 0.00 0.07 0.00 0.00 59.98 59.91 2k40 h ARG 21 Cb 0.17 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 2k40 h ARG 21 CO -0.00 -0.37 -1.05 -0.39 -1.07 0.00 0.00 179.97 177.09 2k40 h VAL 22 N -0.58 1.63 -2.80 2.04 -1.51 -1.53 -3.42 116.25 110.09 2k40 h VAL 22 Ca -0.01 -3.23 -0.60 0.00 -1.23 0.00 0.00 66.70 61.62 2k40 h VAL 22 Cb 0.53 2.83 -0.40 0.00 -2.13 0.00 0.00 31.29 32.12 2k40 h VAL 22 CO -0.05 0.93 -0.78 0.20 -1.23 0.00 0.00 177.57 176.64 2k40 s ASN 23 N -6.86 3.22 0.50 4.19 -0.87 0.29 -4.99 114.94 110.42 2k40 s ASN 23 Ca -0.01 -2.92 0.14 0.00 -1.57 0.00 0.00 52.86 48.50 2k40 s ASN 23 Cb 0.09 -0.92 1.20 0.00 -0.02 0.00 0.00 41.25 41.60 2k40 s ASN 23 CO 0.84 -0.21 2.13 0.00 -2.57 0.00 0.00 177.10 177.29 2k40 s TYR 25 N -5.15 2.02 0.61 0.00 2.02 -1.26 -4.82 117.35 110.77 2k40 s TYR 25 Ca -0.06 -1.81 -0.10 0.00 -0.37 0.00 0.00 57.07 54.73 2k40 s TYR 25 Cb 0.17 -1.78 0.14 0.00 -0.40 0.00 0.00 41.96 40.09 2k40 s TYR 25 CO 0.68 -0.84 0.79 -0.35 -1.57 0.00 0.00 175.55 174.26 2k40 n PRO 26 N 4.76 -0.94 -3.36 -1.71 -0.04 -1.25 -5.12 135.00 127.34 2k40 n PRO 26 Ca -0.04 -1.23 -0.19 0.00 -0.04 0.00 0.00 63.50 62.01 2k40 n PRO 26 Cb 0.43 -0.85 -0.01 0.00 -0.04 0.00 0.00 33.50 33.04 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 -4.65 1.83 0.30 0.55 0.00 -1.26 -5.03 107.32 99.06 2k40 s GLY 27 Ca 0.45 -1.63 0.02 0.00 0.00 0.00 0.00 44.72 43.56 2k40 s GLY 27 CO 0.32 -1.49 1.81 -2.22 0.00 0.00 0.00 173.10 171.52 2k40 h ILE 28 N 0.87 1.22 -0.16 0.90 1.08 -2.00 -2.21 117.51 117.22 2k40 h ILE 28 Ca -0.43 -0.93 -0.05 0.00 -0.39 0.00 0.00 64.86 63.06 2k40 h ILE 28 Cb 1.27 0.96 -0.01 0.00 -3.07 0.00 0.00 36.82 35.96 2k40 h ILE 28 CO 0.51 0.32 -0.14 -0.78 -0.69 0.00 0.00 178.15 177.37 2k40 h ASP 29 N 0.59 0.25 -0.05 1.72 3.58 -1.98 0.23 116.42 120.77 2k40 h ASP 29 Ca 0.12 -0.06 -0.18 0.00 0.42 0.00 0.00 57.03 57.34 2k40 h ASP 29 Cb 0.41 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.39 2k40 h ASP 29 CO 0.02 0.42 -0.59 0.40 -2.88 0.00 0.00 179.24 176.61 2k40 h ILE 30 N 0.25 1.31 -0.13 2.25 1.08 -1.83 0.19 117.51 120.63 2k40 h ILE 30 Ca 0.05 -1.84 -0.03 0.00 -0.39 0.00 0.00 64.86 62.66 2k40 h ILE 30 Cb 0.41 1.79 -0.00 0.00 -3.07 0.00 0.00 36.82 35.95 2k40 h ILE 30 CO 0.02 0.58 -0.02 -0.07 -0.69 0.00 0.00 178.15 177.97 2k40 h LEU 31 N 0.49 0.24 -0.13 1.44 3.38 -0.92 -2.09 115.31 117.72 2k40 h LEU 31 Ca -0.00 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 57.66 2k40 h LEU 31 Cb 1.17 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.79 2k40 h LEU 31 CO 0.12 0.54 -0.25 -0.33 0.09 0.00 0.00 178.44 178.61 2k40 h GLU 32 N -0.06 -0.30 -0.76 1.13 4.39 -0.57 0.11 114.58 118.52 2k40 h GLU 32 Ca 0.03 0.02 0.06 0.00 0.34 0.00 0.00 59.36 59.81 2k40 h GLU 32 Cb 0.43 0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 29.09 2k40 h GLU 32 CO 0.01 -0.20 0.45 0.22 -1.16 0.00 0.00 179.01 178.33 2k40 h ASP 33 N -0.32 0.69 -0.49 1.42 3.58 -0.96 0.17 116.42 120.52 2k40 h ASP 33 Ca 0.10 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 2k40 h ASP 33 Cb 0.47 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 2k40 h ASP 33 CO -0.31 0.44 0.30 -0.07 -2.88 0.00 0.00 179.24 176.72 2k40 h LEU 34 N 0.83 0.58 0.46 2.28 3.38 -1.22 -1.11 115.31 120.50 2k40 h LEU 34 Ca 0.34 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 2k40 h LEU 34 Cb 0.18 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2k40 h LEU 34 CO -0.18 0.46 -0.45 0.00 0.09 0.00 0.00 178.44 178.36 2k40 h ALA 35 N 1.15 -1.01 -0.71 1.53 0.00 -0.14 -2.15 119.26 117.93 2k40 h ALA 35 Ca 0.17 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 55.02 2k40 h ALA 35 Cb -0.02 0.65 -0.08 0.00 0.00 0.00 0.00 17.79 18.34 2k40 h ALA 35 CO -0.03 -1.10 0.33 1.96 0.00 0.00 0.00 179.25 180.41 2k40 h GLN 36 N -0.92 0.54 -0.00 0.00 1.08 -0.63 -1.73 115.11 113.44 2k40 h GLN 36 Ca -0.05 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2k40 h GLN 36 Cb 0.81 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 28.11 2k40 h GLN 36 CO -0.06 0.36 -0.20 1.63 -0.95 0.00 0.00 178.83 179.60 2k40 n LYS 37 N -4.90 0.48 0.00 1.46 4.76 -0.43 -3.96 118.16 115.57 2k40 n LYS 37 Ca 0.12 -0.20 0.00 0.00 -2.87 0.00 0.00 58.31 55.36 2k40 n LYS 37 Cb 0.31 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 2k40 n LYS 37 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2k40 n LEU 38 N -1.09 1.17 -1.86 -0.35 4.77 -0.81 -5.01 117.00 113.82 2k40 n LEU 38 Ca 0.11 -1.17 -0.20 0.00 -0.03 0.00 0.00 56.01 54.72 2k40 n LEU 38 Cb 0.31 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.35 2k40 n LEU 38 CO 0.27 0.29 -0.22 -3.20 -1.33 0.00 0.00 177.39 173.20 2k40 n ASN 39 N -0.13 -5.54 -4.93 -1.43 5.15 -0.69 -5.02 115.26 102.66 2k40 n ASN 39 Ca 0.00 0.27 -0.20 0.00 -0.60 0.00 0.00 54.58 54.05 2k40 n ASN 39 Cb 0.10 -4.69 0.05 0.00 -0.53 0.00 0.00 39.78 34.70 2k40 n ASN 39 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2k40 s LEU 40 N -5.07 3.28 0.30 1.20 1.43 -0.96 -5.04 118.68 113.81 2k40 s LEU 40 Ca 0.00 -0.33 0.09 0.00 -1.03 0.00 0.00 54.13 52.85 2k40 s LEU 40 Cb 0.00 -2.42 -0.04 0.00 0.03 0.00 0.00 46.19 43.76 2k40 s LEU 40 CO 0.00 -1.23 0.10 -1.83 0.23 0.00 0.00 176.35 173.62 2k40 s GLU 41 N -4.72 2.44 0.23 1.70 1.03 -1.26 -4.30 118.70 113.81 2k40 s GLU 41 Ca 0.59 -1.42 -0.09 0.00 0.03 0.00 0.00 54.97 54.08 2k40 s GLU 41 Cb -0.08 -2.24 0.35 0.00 -0.80 0.00 0.00 34.13 31.36 2k40 s GLU 41 CO 0.38 0.24 1.65 1.25 -1.33 0.00 0.00 175.26 177.46 2k40 h LEU 42 N 1.65 -0.32 -1.01 1.83 5.85 -1.95 -1.11 115.31 120.26 2k40 h LEU 42 Ca -0.45 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.45 2k40 h LEU 42 Cb 1.25 0.31 -0.05 0.00 0.37 0.00 0.00 40.66 42.54 2k40 h LEU 42 CO 0.62 -0.14 0.60 0.44 -0.34 0.00 0.00 178.44 179.61 2k40 h ASP 43 N 0.11 1.12 -0.83 1.25 3.32 -1.97 0.94 116.42 120.36 2k40 h ASP 43 Ca 0.36 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.34 2k40 h ASP 43 Cb 0.60 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.83 2k40 h ASP 43 CO -0.59 0.84 0.43 0.03 -1.72 0.00 0.00 179.24 178.23 2k40 h ARG 44 N 1.30 1.17 -0.37 3.56 3.08 -1.62 0.16 114.38 121.66 2k40 h ARG 44 Ca 0.34 -0.15 -0.16 0.00 0.07 0.00 0.00 59.98 60.09 2k40 h ARG 44 Cb -0.10 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.73 2k40 h ARG 44 CO -0.07 0.88 -0.38 0.82 -1.07 0.00 0.00 179.97 180.15 2k40 h ILE 45 N 1.16 1.28 0.09 2.04 1.08 -1.04 0.95 117.51 123.06 2k40 h ILE 45 Ca 0.29 -1.55 0.02 0.00 -0.39 0.00 0.00 64.86 63.23 2k40 h ILE 45 Cb 0.07 1.42 -0.04 0.00 -3.07 0.00 0.00 36.82 35.20 2k40 h ILE 45 CO -0.04 0.52 -0.33 1.56 -0.69 0.00 0.00 178.15 179.17 2k40 h GLN 46 N 0.72 -0.51 -0.89 2.37 4.20 -0.64 0.72 115.11 121.08 2k40 h GLN 46 Ca 0.06 0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 2k40 h GLN 46 Cb 0.97 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.83 2k40 h GLN 46 CO 0.09 -0.34 0.54 0.82 -0.67 0.00 0.00 178.83 179.27 2k40 h ILE 47 N -0.53 1.24 0.05 2.54 5.03 -0.93 0.26 117.51 125.16 2k40 h ILE 47 Ca 0.04 -0.53 -0.00 0.00 -0.12 0.00 0.00 64.86 64.25 2k40 h ILE 47 Cb 0.58 -0.01 0.00 0.00 -3.03 0.00 0.00 36.82 34.36 2k40 h ILE 47 CO -0.21 0.26 -0.02 -0.25 -0.68 0.00 0.00 178.15 177.24 2k40 h TRP 48 N 1.22 -0.06 -0.56 1.37 7.01 -0.46 0.97 115.95 125.44 2k40 h TRP 48 Ca 0.32 -0.00 -0.08 0.00 2.11 0.00 0.00 58.89 61.24 2k40 h TRP 48 Cb -0.05 0.02 -0.02 0.00 -2.10 0.00 0.00 29.16 27.00 2k40 h TRP 48 CO 0.00 -0.01 0.05 0.74 -2.79 0.00 0.00 178.44 176.44 2k40 h PHE 49 N -0.10 1.03 -0.97 2.65 0.04 -0.65 -0.56 116.94 118.38 2k40 h PHE 49 Ca -0.01 -0.16 0.00 0.00 2.80 0.00 0.00 57.97 60.61 2k40 h PHE 49 Cb 0.08 -0.28 -0.05 0.00 2.20 0.00 0.00 35.95 37.91 2k40 h PHE 49 CO -0.06 0.92 0.62 1.96 -0.60 0.00 0.00 178.31 181.14 2k40 h GLN 50 N 0.85 1.30 0.01 1.51 4.20 -0.89 0.20 115.11 122.30 2k40 h GLN 50 Ca 0.17 -0.10 0.02 0.00 0.06 0.00 0.00 58.65 58.80 2k40 h GLN 50 Cb 0.47 -0.28 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 2k40 h GLN 50 CO 0.02 0.88 -0.13 -0.91 -0.67 0.00 0.00 178.83 178.02 2k40 h ASN 51 N 1.33 -0.38 -0.52 1.46 2.35 -0.46 0.13 115.58 119.49 2k40 h ASN 51 Ca 0.35 0.06 0.01 0.00 -0.55 0.00 0.00 56.30 56.16 2k40 h ASN 51 Cb -0.11 0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 2k40 h ASN 51 CO -0.07 -0.19 0.34 0.03 -1.65 0.00 0.00 177.43 175.89 2k40 h ARG 52 N -0.23 0.68 -0.18 0.81 -0.00 -0.59 0.44 114.38 115.31 2k40 h ARG 52 Ca 0.04 -0.04 -0.14 0.00 -0.50 0.00 0.00 59.98 59.34 2k40 h ARG 52 Cb 0.28 -0.15 -0.01 0.00 0.00 0.00 0.00 29.97 30.09 2k40 h ARG 52 CO -0.12 0.45 -0.49 -0.09 0.00 0.00 0.00 179.97 179.72 2k40 h ARG 53 N 0.70 0.47 -0.39 0.04 1.12 -0.59 -2.91 114.38 112.82 2k40 h ARG 53 Ca 0.19 -0.27 0.00 0.00 -1.11 0.00 0.00 59.98 58.79 2k40 h ARG 53 Cb -0.08 0.02 -0.02 0.00 -0.01 0.00 0.00 29.97 29.88 2k40 h ARG 53 CO -0.04 0.86 0.25 0.00 -3.11 0.00 0.00 179.97 177.92 2k40 h ALA 54 N 1.09 0.50 -0.99 2.80 0.00 -0.48 -3.17 119.26 119.01 2k40 h ALA 54 Ca 0.02 -0.04 0.29 0.00 0.00 0.00 0.00 54.91 55.17 2k40 h ALA 54 Cb 1.00 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 2k40 h ALA 54 CO 0.09 -0.02 0.76 -0.22 0.00 0.00 0.00 179.25 179.86 2k40 h LYS 55 N 0.52 0.00 0.00 0.00 3.11 -0.71 0.24 116.57 119.73 2k40 h LYS 55 Ca 0.14 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.96 2k40 h LYS 55 Cb -0.02 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.20 2k40 h LYS 55 CO -0.03 0.00 -0.08 -0.07 -2.81 0.00 0.00 179.45 176.46 2k40 h LEU 56 N 0.00 0.00 -0.25 5.20 4.07 -1.57 -3.38 115.31 119.38 2k40 h LEU 56 Ca 0.47 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.43 2k40 h LEU 56 Cb 1.99 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.73 2k40 h LEU 56 CO -0.00 0.08 0.00 0.29 -1.08 0.00 0.00 178.44 177.73 2k40 n LYS 57 N -3.26 0.00 -3.81 1.13 5.02 0.09 -5.12 118.16 112.21 2k40 n LYS 57 Ca -0.00 -0.12 -0.10 0.00 -2.02 0.00 0.00 58.31 56.07 2k40 n LYS 57 Cb 0.31 -0.42 -0.07 0.00 -0.02 0.00 0.00 35.03 34.82 2k40 n LYS 57 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2k40 s ARG 58 N 0.00 0.85 1.58 1.97 3.52 0.61 -5.11 118.95 122.36 2k40 s ARG 58 Ca 0.00 -0.82 0.00 0.00 -0.13 0.00 0.00 55.73 54.78 2k40 s ARG 58 Cb 0.00 0.35 0.00 0.00 -1.56 0.00 0.00 34.95 33.74 2k40 s ARG 58 CO 0.00 -0.28 0.00 0.43 -0.81 0.00 0.00 175.30 174.64 2k40 n SER 59 N 0.11 -5.82 0.00 -2.12 7.64 -1.26 -3.62 113.62 108.55 2k40 n SER 59 Ca -0.16 0.27 0.00 0.00 1.01 0.00 0.00 58.87 59.99 2k40 n SER 59 Cb 0.62 -0.77 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 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 -2.20 -0.63 -3.12 1.43 8.25 -1.26 -4.74 115.22 112.94 2k40 n HIS 60 Ca 0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.28 2k40 n HIS 60 Cb 0.12 0.13 -0.05 0.00 1.12 0.00 0.00 29.99 31.31 2k40 n HIS 60 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 2k40 n ARG 61 N 0.00 0.42 -2.41 -0.41 -4.01 -1.26 -5.08 116.66 103.91 2k40 n ARG 61 Ca 0.00 -2.73 -0.43 0.00 -1.04 0.00 0.00 57.85 53.65 2k40 n ARG 61 Cb 0.00 -1.52 0.00 0.00 -3.04 0.00 0.00 32.46 27.90 2k40 n ARG 61 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 2k40 n GLU 62 N 2.54 3.44 -4.05 2.89 -0.58 -1.26 -4.87 120.64 118.75 2k40 n GLU 62 Ca 0.23 -3.46 -0.12 0.00 -0.42 0.00 0.00 57.16 53.39 2k40 n GLU 62 Cb 0.52 -3.03 -0.04 0.00 -0.57 0.00 0.00 31.44 28.32 2k40 n GLU 62 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2k40 s SER 63 N 1.79 0.48 -0.95 1.62 0.01 -1.26 -5.10 113.70 110.30 2k40 s SER 63 Ca 0.42 -1.28 -0.24 0.00 1.31 0.00 0.00 55.95 56.16 2k40 s SER 63 Cb 0.07 0.64 -0.02 0.00 0.21 0.00 0.00 66.02 66.91 2k40 s SER 63 CO -0.00 -1.25 1.82 -1.58 0.41 0.00 0.00 173.24 172.64 2k40 s GLN 64 N -3.37 2.83 0.62 12.44 0.74 -1.26 -4.86 119.66 126.79 2k40 s GLN 64 Ca 0.27 -0.56 0.41 0.00 0.05 0.00 0.00 55.36 55.54 2k40 s GLN 64 Cb -0.00 -5.15 2.21 0.00 1.10 0.00 0.00 33.01 31.17 2k40 s GLN 64 CO 0.16 -3.11 2.26 0.35 -0.55 0.00 0.00 175.29 174.40 2k40 h PHE 65 N 10.79 0.00 -1.39 1.67 3.57 -1.99 -3.39 116.94 126.20 2k40 h PHE 65 Ca 0.13 0.00 -0.37 0.00 3.53 0.00 0.00 57.97 61.26 2k40 h PHE 65 Cb 1.00 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 2k40 h PHE 65 CO 1.24 0.00 1.14 -1.17 -2.23 0.00 0.00 178.31 177.29 2k40 s LEU 66 N -5.95 3.24 0.00 0.59 1.98 -1.26 -5.27 118.68 112.01 2k40 s LEU 66 Ca -0.04 0.41 0.26 0.00 -2.89 0.00 0.00 54.13 51.87 2k40 s LEU 66 Cb 0.12 -2.53 0.72 0.00 0.66 0.00 0.00 46.19 45.17 2k40 s LEU 66 CO 0.39 -2.88 1.56 0.80 -1.89 0.00 0.00 176.35 174.34