#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ibk s ARG 3 N 0.00 3.56 0.35 0.00 3.00 -1.26 -4.96 118.95 119.64 1ibk s ARG 3 Ca 0.00 -0.50 0.15 0.00 0.00 0.00 0.00 55.73 55.38 1ibk s ARG 3 Cb 0.00 -2.89 1.05 0.00 0.00 0.00 0.00 34.95 33.11 1ibk s ARG 3 CO 0.00 0.32 1.70 0.87 0.00 0.00 0.00 175.30 178.19 1ibk h LYS 4 N 6.44 0.39 -0.46 3.54 1.57 -2.02 1.69 116.57 127.73 1ibk h LYS 4 Ca -0.34 -0.02 0.09 0.00 -1.87 0.00 0.00 60.65 58.50 1ibk h LYS 4 Cb 1.19 -0.09 -0.09 0.00 0.08 0.00 0.00 32.23 33.32 1ibk h LYS 4 CO 0.62 0.26 -0.10 0.00 -0.57 0.00 0.00 179.45 179.65 1ibk h ALA 5 N 1.75 0.31 -0.24 3.86 0.00 -2.04 0.21 119.26 123.11 1ibk h ALA 5 Ca 0.69 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.74 1ibk h ALA 5 Cb 1.57 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 1ibk h ALA 5 CO -0.49 -0.44 0.05 1.28 0.00 0.00 0.00 179.25 179.64 1ibk n LEU 6 N -5.33 3.07 -2.40 0.00 4.77 0.56 -3.90 117.00 113.78 1ibk n LEU 6 Ca 0.04 -1.57 -0.14 0.00 -0.03 0.00 0.00 56.01 54.31 1ibk n LEU 6 Cb 0.24 -0.58 0.03 0.00 -2.33 0.00 0.00 43.42 40.79 1ibk n LEU 6 CO 0.13 0.45 0.09 -0.38 -1.33 0.00 0.00 177.39 176.35 1ibk n ILE 7 N 0.17 1.96 1.03 -0.08 5.41 0.74 -4.63 119.36 123.96 1ibk n ILE 7 Ca 0.13 -3.67 0.13 0.00 1.00 0.00 0.00 62.75 60.33 1ibk n ILE 7 Cb 0.67 -0.07 0.35 0.00 -0.71 0.00 0.00 39.64 39.87 1ibk n ILE 7 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 1ibk n GLU 8 N -0.64 0.08 -0.33 0.38 0.00 -1.24 -3.99 120.64 114.90 1ibk n GLU 8 Ca 0.27 -0.04 0.14 0.00 0.00 0.00 0.00 57.16 57.54 1ibk n GLU 8 Cb 0.88 -1.50 0.29 0.00 0.00 0.00 0.00 31.44 31.11 1ibk n GLU 8 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 1ibk h LYS 9 N 0.10 0.04 -0.78 3.44 3.11 -1.90 1.16 116.57 121.74 1ibk h LYS 9 Ca 0.00 -0.00 0.23 0.00 -2.81 0.00 0.00 60.65 58.06 1ibk h LYS 9 Cb 0.49 -0.01 -0.03 0.00 -1.00 0.00 0.00 32.23 31.68 1ibk h LYS 9 CO 0.00 0.03 0.66 0.00 -2.81 0.00 0.00 179.45 177.33 1ibk h ALA 10 N 1.94 2.63 0.00 5.00 0.00 -1.96 0.64 119.26 127.51 1ibk h ALA 10 Ca 0.59 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.47 1ibk h ALA 10 Cb 1.21 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1ibk h ALA 10 CO -0.86 -1.06 0.00 0.36 0.00 0.00 0.00 179.25 177.68 1ibk n LYS 11 N -3.94 0.31 0.00 0.00 2.85 0.40 -4.91 118.16 112.86 1ibk n LYS 11 Ca 0.16 0.10 0.00 0.00 -1.05 0.00 0.00 58.31 57.52 1ibk n LYS 11 Cb 0.94 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.82 1ibk n LYS 11 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 1ibk n ARG 12 N -1.19 0.00 -3.47 -1.58 0.00 0.22 -4.87 116.66 105.77 1ibk n ARG 12 Ca 0.09 0.00 -0.18 0.00 -0.00 0.00 0.00 57.85 57.75 1ibk n ARG 12 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.56 1ibk n ARG 12 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1ibk n THR 13 N 0.00 -1.70 -0.09 5.15 -1.04 -1.26 -4.83 114.28 110.51 1ibk n THR 13 Ca 0.00 -0.11 -0.10 0.00 -2.04 0.00 0.00 64.05 61.80 1ibk n THR 13 Cb 0.00 -1.50 -0.03 0.00 -1.82 0.00 0.00 70.33 66.98 1ibk n THR 13 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1ibk h PRO 14 N 0.12 0.43 0.00 -2.82 0.13 -1.94 -3.46 132.00 124.47 1ibk h PRO 14 Ca -0.38 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1ibk h PRO 14 Cb 0.80 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1ibk h PRO 14 CO 0.24 0.45 0.00 1.17 -0.23 0.00 0.00 178.00 179.63 1ibk n LYS 15 N -4.75 0.00 -3.52 0.86 4.81 -1.26 -4.82 118.16 109.48 1ibk n LYS 15 Ca -0.02 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.42 1ibk n LYS 15 Cb 0.13 -0.48 -0.04 0.00 0.02 0.00 0.00 35.03 34.66 1ibk n LYS 15 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1ibk s PHE 16 N -2.01 -0.95 -0.81 5.64 0.40 -1.26 -5.03 117.98 113.97 1ibk s PHE 16 Ca 0.00 1.66 0.00 0.00 -0.60 0.00 0.00 56.93 57.99 1ibk s PHE 16 Cb 0.00 0.57 0.00 0.00 0.51 0.00 0.00 43.02 44.10 1ibk s PHE 16 CO 0.00 -0.47 0.89 0.36 0.70 0.00 0.00 175.22 176.70 1ibk n LYS 17 N 5.05 0.00 -1.66 0.44 -0.00 -1.26 -2.44 118.16 118.29 1ibk n LYS 17 Ca -0.11 0.39 -0.36 0.00 -0.00 0.00 0.00 58.31 58.24 1ibk n LYS 17 Cb 0.52 -1.60 0.04 0.00 -0.00 0.00 0.00 35.03 33.98 1ibk n LYS 17 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1ibk n VAL 18 N -1.39 3.53 -0.70 0.58 0.24 -1.26 -3.86 118.33 115.47 1ibk n VAL 18 Ca 0.00 -3.63 0.00 0.00 -2.04 0.00 0.00 64.34 58.67 1ibk n VAL 18 Cb 0.10 -1.27 0.00 0.00 -1.47 0.00 0.00 33.84 31.20 1ibk n VAL 18 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1ibk n ARG 19 N -0.39 0.00 -2.26 7.34 1.74 -1.02 -5.09 116.66 116.97 1ibk n ARG 19 Ca 0.54 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 57.24 1ibk n ARG 19 Cb 0.40 -0.24 -0.01 0.00 -1.02 0.00 0.00 32.46 31.59 1ibk n ARG 19 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ibk s ALA 20 N 0.00 3.10 -0.43 7.54 0.00 -1.25 -5.02 121.76 125.70 1ibk s ALA 20 Ca 0.00 0.98 0.08 0.00 0.00 0.00 0.00 51.96 53.02 1ibk s ALA 20 Cb 0.00 -3.39 0.29 0.00 0.00 0.00 0.00 23.12 20.02 1ibk s ALA 20 CO 0.00 -0.60 0.84 2.48 0.00 0.00 0.00 175.76 178.48 1ibk n TYR 21 N -0.12 -1.70 0.00 0.00 4.11 -1.26 -5.09 117.16 113.10 1ibk n TYR 21 Ca 0.05 -2.76 0.00 0.00 -0.00 0.00 0.00 57.90 55.19 1ibk n TYR 21 Cb 0.47 0.69 0.00 0.00 -0.00 0.00 0.00 39.34 40.50 1ibk n TYR 21 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 1ibk n THR 22 N 0.86 0.00 -0.96 -3.48 -2.24 -1.26 -4.91 114.28 102.29 1ibk n THR 22 Ca 0.15 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.04 1ibk n THR 22 Cb 0.64 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.81 1ibk n THR 22 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ibk n ARG 23 N 0.00 -2.19 -3.43 -0.78 5.12 -1.26 -4.83 116.66 109.29 1ibk n ARG 23 Ca 0.00 1.76 -0.37 0.00 -1.93 0.00 0.00 57.85 57.30 1ibk n ARG 23 Cb 0.00 -2.57 -0.06 0.00 -1.16 0.00 0.00 32.46 28.67 1ibk n ARG 23 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ibk n VAL 25 N 3.33 0.00 0.00 0.00 3.14 -0.52 -1.59 118.33 122.70 1ibk n VAL 25 Ca -0.10 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.28 1ibk n VAL 25 Cb 0.52 -0.71 0.00 0.00 -1.06 0.00 0.00 33.84 32.59 1ibk n VAL 25 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 1ibk n ARG 26 N -1.00 0.00 0.02 1.45 0.63 -1.26 -4.85 116.66 111.65 1ibk n ARG 26 Ca 0.14 0.00 0.14 0.00 -0.92 0.00 0.00 57.85 57.20 1ibk n ARG 26 Cb 0.06 0.00 0.52 0.00 0.45 0.00 0.00 32.46 33.50 1ibk n ARG 26 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ibk n GLY 28 N 1.47 -0.21 0.00 0.00 0.00 -0.62 -4.88 105.19 100.95 1ibk n GLY 28 Ca 0.06 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1ibk n GLY 28 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ibk n ARG 29 N -2.51 1.10 0.00 1.61 3.00 -1.26 -4.27 116.66 114.33 1ibk n ARG 29 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.66 1ibk n ARG 29 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.10 1ibk n ARG 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ibk n ALA 30 N -3.00 0.00 0.22 5.13 0.00 -1.26 -3.90 120.51 117.70 1ibk n ALA 30 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 1ibk n ALA 30 Cb 0.00 0.00 0.51 0.00 0.00 0.00 0.00 19.45 19.96 1ibk n ALA 30 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1ibk h ARG 31 N 0.00 0.00 -0.17 0.00 9.65 -1.97 -3.34 114.38 118.54 1ibk h ARG 31 Ca 0.00 0.00 -0.20 0.00 -1.10 0.00 0.00 59.98 58.68 1ibk h ARG 31 Cb 0.00 0.00 -0.35 0.00 -1.39 0.00 0.00 29.97 28.23 1ibk h ARG 31 CO 0.00 0.25 -0.95 -1.13 2.80 0.00 0.00 179.97 180.95 1ibk n SER 32 N -3.75 0.87 -4.67 -3.80 3.41 -1.26 -5.05 113.62 99.37 1ibk n SER 32 Ca -0.01 -2.03 -0.47 0.00 -0.26 0.00 0.00 58.87 56.10 1ibk n SER 32 Cb 0.36 -0.24 -0.04 0.00 -0.26 0.00 0.00 64.21 64.02 1ibk n SER 32 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1ibk n VAL 33 N -0.15 0.30 -1.71 -3.33 0.24 -1.26 -2.52 118.33 109.90 1ibk n VAL 33 Ca 0.02 -0.05 -0.33 0.00 -2.04 0.00 0.00 64.34 61.93 1ibk n VAL 33 Cb 0.95 -1.70 -0.01 0.00 -1.47 0.00 0.00 33.84 31.61 1ibk n VAL 33 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1ibk n TYR 34 N 5.05 2.22 0.00 6.34 4.02 0.59 -4.94 117.16 130.43 1ibk n TYR 34 Ca 0.20 -2.14 0.00 0.00 -0.01 0.00 0.00 57.90 55.95 1ibk n TYR 34 Cb 0.29 -1.31 0.00 0.00 -0.02 0.00 0.00 39.34 38.29 1ibk n TYR 34 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1ibk n ARG 35 N 0.31 0.00 0.14 -0.72 1.74 -1.26 -1.35 116.66 115.51 1ibk n ARG 35 Ca 0.51 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.59 1ibk n ARG 35 Cb 0.40 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.84 1ibk n ARG 35 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ibk n PHE 36 N 0.00 0.00 0.00 -1.55 -0.00 -1.26 -0.15 117.46 114.50 1ibk n PHE 36 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1ibk n PHE 36 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 1ibk n PHE 36 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1ibk n PHE 37 N -1.45 0.00 -0.58 -5.13 3.01 -0.46 -4.99 117.46 107.86 1ibk n PHE 37 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1ibk n PHE 37 Cb 0.59 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.06 1ibk n PHE 37 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ibk n GLY 38 N 2.53 1.08 3.95 1.37 0.00 0.79 -4.95 105.19 109.95 1ibk n GLY 38 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1ibk n GLY 38 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ibk s LEU 39 N 0.00 4.22 0.37 0.99 1.43 -1.26 -1.43 118.68 122.99 1ibk s LEU 39 Ca 0.00 0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.38 1ibk s LEU 39 Cb 0.00 -3.07 -0.03 0.00 0.03 0.00 0.00 46.19 43.12 1ibk s LEU 39 CO 0.00 -0.09 0.58 0.00 0.23 0.00 0.00 176.35 177.06 1ibk h ARG 41 N 0.68 0.25 0.30 0.00 -0.00 -1.87 -0.30 114.38 113.45 1ibk h ARG 41 Ca -0.49 -0.01 -0.01 0.00 -0.00 0.00 0.00 59.98 59.46 1ibk h ARG 41 Cb 1.22 -0.06 0.00 0.00 -0.00 0.00 0.00 29.97 31.14 1ibk h ARG 41 CO 0.61 0.16 -0.15 0.82 -0.00 0.00 0.00 179.97 181.42 1ibk h ILE 42 N 0.25 0.37 -0.65 0.08 2.04 -1.93 -3.22 117.51 114.46 1ibk h ILE 42 Ca 0.72 -0.81 0.10 0.00 1.00 0.00 0.00 64.86 65.87 1ibk h ILE 42 Cb 1.97 0.61 -0.07 0.00 -0.74 0.00 0.00 36.82 38.58 1ibk h ILE 42 CO -0.42 0.09 0.27 0.00 0.00 0.00 0.00 178.15 178.09 1ibk h LEU 44 N 0.46 0.00 0.11 0.00 8.10 -1.24 0.20 115.31 122.93 1ibk h LEU 44 Ca 0.33 0.00 -0.30 0.00 0.11 0.00 0.00 57.88 58.02 1ibk h LEU 44 Cb 0.39 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.61 1ibk h LEU 44 CO -0.30 0.04 -1.48 -0.09 -4.11 0.00 0.00 178.44 172.49 1ibk h ARG 45 N 0.00 0.23 -0.17 0.17 2.43 -1.21 -0.81 114.38 115.01 1ibk h ARG 45 Ca -0.00 -0.39 -0.02 0.00 -0.81 0.00 0.00 59.98 58.76 1ibk h ARG 45 Cb 0.08 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1ibk h ARG 45 CO 0.01 1.09 0.03 0.93 -1.51 0.00 0.00 179.97 180.51 1ibk h GLU 46 N 0.06 0.29 -0.25 0.20 5.08 -0.31 -1.73 114.58 117.92 1ibk h GLU 46 Ca -0.22 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 57.95 1ibk h GLU 46 Cb 2.00 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 31.21 1ibk h GLU 46 CO 0.16 0.46 -0.28 -0.07 -1.00 0.00 0.00 179.01 178.29 1ibk h LEU 47 N 0.08 0.67 -0.98 1.33 3.38 -0.75 -3.12 115.31 115.92 1ibk h LEU 47 Ca 0.05 -0.48 0.12 0.00 0.09 0.00 0.00 57.88 57.65 1ibk h LEU 47 Cb 0.31 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 40.79 1ibk h LEU 47 CO 0.00 1.02 0.61 0.00 0.09 0.00 0.00 178.44 180.17 1ibk h ALA 48 N 0.67 1.47 -0.39 1.53 0.00 -1.11 0.10 119.26 121.53 1ibk h ALA 48 Ca 0.04 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1ibk h ALA 48 Cb 0.84 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1ibk h ALA 48 CO 0.07 0.21 0.13 0.45 0.00 0.00 0.00 179.25 180.11 1ibk h HIS 49 N 0.97 0.55 0.13 0.00 3.86 -1.25 -3.28 115.15 116.13 1ibk h HIS 49 Ca 0.48 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.66 1ibk h HIS 49 Cb 0.47 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.77 1ibk h HIS 49 CO -0.01 0.45 -0.06 0.87 0.86 0.00 0.00 177.93 180.04 1ibk h LYS 50 N 0.55 -0.17 0.00 2.45 1.57 -0.83 -3.49 116.57 116.65 1ibk h LYS 50 Ca 0.13 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1ibk h LYS 50 Cb 0.15 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1ibk h LYS 50 CO -0.01 -0.11 0.00 0.41 -0.57 0.00 0.00 179.45 179.17 1ibk n GLY 51 N 1.01 0.31 0.57 3.86 0.00 -0.35 -5.00 105.19 105.59 1ibk n GLY 51 Ca -0.02 0.00 0.39 0.00 0.00 0.00 0.00 46.02 46.39 1ibk n GLY 51 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1ibk h GLN 52 N 0.00 0.02 -4.16 1.61 1.08 -1.86 -3.28 115.11 108.53 1ibk h GLN 52 Ca 0.00 -0.00 -0.75 0.00 -1.45 0.00 0.00 58.65 56.45 1ibk h GLN 52 Cb 0.00 -0.01 -0.24 0.00 -0.05 0.00 0.00 27.48 27.18 1ibk h GLN 52 CO 0.00 0.01 -0.26 -0.51 -0.95 0.00 0.00 178.83 177.12 1ibk s LEU 53 N -8.34 6.00 0.37 1.46 1.43 -1.26 -5.05 118.68 113.30 1ibk s LEU 53 Ca -0.05 -1.69 -0.28 0.00 -1.03 0.00 0.00 54.13 51.07 1ibk s LEU 53 Cb 0.24 -2.18 -0.11 0.00 0.03 0.00 0.00 46.19 44.18 1ibk s LEU 53 CO 0.83 -0.79 1.44 -2.16 0.23 0.00 0.00 176.35 175.89 1ibk s PRO 54 N 1.58 4.14 0.00 1.29 0.04 -1.24 -2.62 135.00 138.20 1ibk s PRO 54 Ca 0.03 2.47 0.00 0.00 0.04 0.00 0.00 61.00 63.54 1ibk s PRO 54 Cb -0.28 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1ibk s PRO 54 CO 0.03 -0.46 0.00 0.41 0.04 0.00 0.00 177.00 177.02 1ibk n GLY 55 N 0.55 0.57 3.28 0.56 0.00 -1.26 -4.85 105.19 104.03 1ibk n GLY 55 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1ibk n GLY 55 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ibk n VAL 56 N -2.00 4.06 -2.00 1.61 0.31 -1.08 -4.96 118.33 114.26 1ibk n VAL 56 Ca 0.00 -4.22 -0.28 0.00 -0.01 0.00 0.00 64.34 59.83 1ibk n VAL 56 Cb 0.00 -2.43 0.09 0.00 -0.91 0.00 0.00 33.84 30.59 1ibk n VAL 56 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1ibk s ARG 57 N 2.42 1.91 -0.11 5.55 3.52 -1.26 -4.93 118.95 126.04 1ibk s ARG 57 Ca 0.46 -0.06 -0.29 0.00 -0.13 0.00 0.00 55.73 55.71 1ibk s ARG 57 Cb 0.04 -2.01 -0.01 0.00 -1.56 0.00 0.00 34.95 31.41 1ibk s ARG 57 CO 0.01 -1.56 0.97 0.15 -0.81 0.00 0.00 175.30 174.06 1ibk s LYS 58 N -5.50 4.41 0.33 5.12 1.02 -1.26 -5.00 119.74 118.86 1ibk s LYS 58 Ca 0.63 1.32 -0.29 0.00 0.02 0.00 0.00 55.97 57.65 1ibk s LYS 58 Cb -0.10 -3.54 -0.10 0.00 -0.52 0.00 0.00 37.83 33.57 1ibk s LYS 58 CO 0.48 -0.28 1.36 0.00 -0.92 0.00 0.00 175.35 175.99 1ibk s ALA 59 N 1.91 3.53 -0.28 5.17 0.00 -1.26 -5.02 121.76 125.81 1ibk s ALA 59 Ca 0.47 1.33 -0.21 0.00 0.00 0.00 0.00 51.96 53.54 1ibk s ALA 59 Cb -0.18 -3.51 0.12 0.00 0.00 0.00 0.00 23.12 19.54 1ibk s ALA 59 CO 0.18 -0.73 0.93 0.45 0.00 0.00 0.00 175.76 176.59 1ibk s SER 60 N -0.29 -0.58 0.00 0.00 0.15 -1.26 -5.33 113.70 106.40 1ibk s SER 60 Ca 0.51 1.01 0.00 0.00 0.70 0.00 0.00 55.95 58.17 1ibk s SER 60 Cb -0.41 1.13 0.00 0.00 -1.71 0.00 0.00 66.02 65.02 1ibk s SER 60 CO 0.53 -0.17 0.00 -2.67 1.20 0.00 0.00 173.24 172.13