#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ibm s ARG 3 N 0.00 3.31 0.09 0.00 3.00 -1.26 -4.95 118.95 119.14 1ibm s ARG 3 Ca 0.00 0.95 -0.24 0.00 0.00 0.00 0.00 55.73 56.44 1ibm s ARG 3 Cb 0.00 -2.04 -0.15 0.00 0.00 0.00 0.00 34.95 32.76 1ibm s ARG 3 CO 0.00 -0.80 1.72 0.87 0.00 0.00 0.00 175.30 177.09 1ibm h LYS 4 N -0.18 -0.12 -0.93 3.54 1.79 -2.03 -1.56 116.57 117.08 1ibm h LYS 4 Ca -0.45 0.01 0.27 0.00 -2.18 0.00 0.00 60.65 58.30 1ibm h LYS 4 Cb 1.20 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.84 1ibm h LYS 4 CO 0.59 -0.08 0.67 0.00 -1.08 0.00 0.00 179.45 179.55 1ibm h ALA 5 N 0.79 2.87 -0.70 3.86 0.00 -2.04 0.22 119.26 124.27 1ibm h ALA 5 Ca -0.01 -0.03 -0.37 0.00 0.00 0.00 0.00 54.91 54.50 1ibm h ALA 5 Cb 0.11 0.07 -0.22 0.00 0.00 0.00 0.00 17.79 17.75 1ibm h ALA 5 CO 0.01 -1.15 0.47 1.28 0.00 0.00 0.00 179.25 179.86 1ibm n LEU 6 N -4.24 5.70 -1.13 0.00 4.77 -0.59 -3.43 117.00 118.08 1ibm n LEU 6 Ca 0.19 -3.02 -0.01 0.00 -0.03 0.00 0.00 56.01 53.15 1ibm n LEU 6 Cb 1.00 -0.75 0.14 0.00 -2.33 0.00 0.00 43.42 41.47 1ibm n LEU 6 CO 0.39 0.91 0.26 -0.38 -1.33 0.00 0.00 177.39 177.24 1ibm n ILE 7 N -0.62 1.91 0.35 -0.08 5.41 0.78 -4.60 119.36 122.51 1ibm n ILE 7 Ca 0.42 -3.10 0.05 0.00 1.00 0.00 0.00 62.75 61.12 1ibm n ILE 7 Cb 1.28 -0.16 0.19 0.00 -0.71 0.00 0.00 39.64 40.23 1ibm n ILE 7 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 1ibm n GLU 8 N -0.78 2.53 0.12 0.38 0.28 -1.22 -2.79 120.64 119.16 1ibm n GLU 8 Ca 0.22 -1.51 0.06 0.00 -0.16 0.00 0.00 57.16 55.76 1ibm n GLU 8 Cb 0.82 -1.64 0.02 0.00 1.43 0.00 0.00 31.44 32.07 1ibm n GLU 8 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 1ibm h LYS 9 N 2.13 0.00 0.00 3.44 3.11 -1.90 -2.91 116.57 120.44 1ibm h LYS 9 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1ibm h LYS 9 Cb 0.94 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.17 1ibm h LYS 9 CO 0.15 0.20 0.01 0.00 -2.81 0.00 0.00 179.45 177.00 1ibm h ALA 10 N 1.72 1.01 -1.38 5.00 0.00 -1.90 -3.37 119.26 120.33 1ibm h ALA 10 Ca -0.04 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.34 1ibm h ALA 10 Cb 1.25 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 1ibm h ALA 10 CO 0.03 -0.01 1.16 0.15 0.00 0.00 0.00 179.25 180.58 1ibm s LYS 11 N -3.58 3.01 0.00 0.00 1.02 -1.10 -4.80 119.74 114.29 1ibm s LYS 11 Ca -0.03 -0.00 0.06 0.00 0.02 0.00 0.00 55.97 56.02 1ibm s LYS 11 Cb 0.07 -4.31 0.34 0.00 -0.52 0.00 0.00 37.83 33.41 1ibm s LYS 11 CO 0.21 -2.36 0.82 -2.13 -0.92 0.00 0.00 175.35 170.96 1ibm n ARG 12 N 9.29 0.18 -3.47 1.68 0.63 -1.26 -3.72 116.66 119.99 1ibm n ARG 12 Ca 0.10 0.01 -0.42 0.00 -0.92 0.00 0.00 57.85 56.62 1ibm n ARG 12 Cb 0.50 -1.50 -0.04 0.00 0.45 0.00 0.00 32.46 31.87 1ibm n ARG 12 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1ibm s THR 13 N -2.03 5.13 0.17 5.15 2.01 -1.26 -4.91 115.64 119.91 1ibm s THR 13 Ca 0.09 -3.14 -0.00 0.00 0.31 0.00 0.00 61.69 58.95 1ibm s THR 13 Cb 0.04 -4.16 -0.13 0.00 0.01 0.00 0.00 72.50 68.26 1ibm s THR 13 CO 0.07 -1.06 1.40 1.55 -0.69 0.00 0.00 174.62 175.89 1ibm h PRO 14 N 6.94 0.32 0.00 4.92 0.13 -1.95 -3.47 132.00 138.89 1ibm h PRO 14 Ca 0.12 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 1ibm h PRO 14 Cb 0.93 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1ibm h PRO 14 CO 0.84 0.97 0.00 1.17 -0.23 0.00 0.00 178.00 180.75 1ibm n LYS 15 N -3.76 0.00 -3.36 0.86 4.81 -1.26 -4.91 118.16 110.53 1ibm n LYS 15 Ca -0.04 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.42 1ibm n LYS 15 Cb 0.76 -1.30 -0.04 0.00 0.02 0.00 0.00 35.03 34.46 1ibm n LYS 15 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1ibm s PHE 16 N -2.98 -0.41 0.27 5.64 2.99 -1.26 -5.07 117.98 117.16 1ibm s PHE 16 Ca 0.00 0.72 -0.04 0.00 0.00 0.00 0.00 56.93 57.61 1ibm s PHE 16 Cb 0.00 0.24 0.54 0.00 0.00 0.00 0.00 43.02 43.81 1ibm s PHE 16 CO 0.00 -0.20 1.61 -0.22 -0.00 0.00 0.00 175.22 176.41 1ibm h LYS 17 N 7.03 0.07 -0.46 0.44 1.63 -2.01 -2.54 116.57 120.73 1ibm h LYS 17 Ca -0.17 -0.00 0.04 0.00 -0.85 0.00 0.00 60.65 59.67 1ibm h LYS 17 Cb 1.13 -0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.71 1ibm h LYS 17 CO 0.10 0.04 0.23 -0.39 -3.45 0.00 0.00 179.45 175.98 1ibm h VAL 18 N 0.07 0.97 0.00 2.00 -1.51 -1.98 -3.10 116.25 112.70 1ibm h VAL 18 Ca 0.48 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 65.79 1ibm h VAL 18 Cb 0.89 0.47 0.00 0.00 -2.13 0.00 0.00 31.29 30.52 1ibm h VAL 18 CO -0.78 0.08 0.00 0.54 -1.23 0.00 0.00 177.57 176.19 1ibm n ARG 19 N -4.90 0.00 -3.18 5.19 1.74 -0.96 -4.70 116.66 109.86 1ibm n ARG 19 Ca 0.03 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.72 1ibm n ARG 19 Cb 0.11 -0.94 -0.05 0.00 -1.02 0.00 0.00 32.46 30.56 1ibm n ARG 19 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ibm s ALA 20 N -0.99 3.42 -0.19 7.54 0.00 -1.17 -5.00 121.76 125.37 1ibm s ALA 20 Ca 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 51.96 51.86 1ibm s ALA 20 Cb 0.00 -2.81 0.07 0.00 0.00 0.00 0.00 23.12 20.37 1ibm s ALA 20 CO 0.00 -0.10 0.10 1.52 0.00 0.00 0.00 175.76 177.27 1ibm s TYR 21 N 0.83 0.24 0.00 0.00 1.13 -1.26 -5.09 117.35 113.19 1ibm s TYR 21 Ca 0.31 -0.42 0.00 0.00 -1.41 0.00 0.00 57.07 55.55 1ibm s TYR 21 Cb -0.16 -0.74 0.00 0.00 -1.10 0.00 0.00 41.96 39.96 1ibm s TYR 21 CO 0.14 -0.57 0.00 0.25 -2.51 0.00 0.00 175.55 172.86 1ibm n THR 22 N 5.27 0.00 -1.12 -3.49 -2.24 -1.26 -4.94 114.28 106.50 1ibm n THR 22 Ca -0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1ibm n THR 22 Cb 0.48 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1ibm n THR 22 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ibm n ARG 23 N 0.00 -3.08 -2.73 -0.78 5.12 -1.26 -4.91 116.66 109.02 1ibm n ARG 23 Ca 0.00 2.34 -0.35 0.00 -1.93 0.00 0.00 57.85 57.91 1ibm n ARG 23 Cb 0.00 -2.77 -0.06 0.00 -1.16 0.00 0.00 32.46 28.47 1ibm n ARG 23 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ibm n VAL 25 N -0.14 2.56 0.00 0.00 3.14 -0.69 -2.96 118.33 120.23 1ibm n VAL 25 Ca 0.05 -1.34 0.00 0.00 -2.96 0.00 0.00 64.34 60.09 1ibm n VAL 25 Cb 0.52 -0.37 0.00 0.00 -1.06 0.00 0.00 33.84 32.93 1ibm n VAL 25 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 1ibm n ARG 26 N 0.16 0.00 0.00 1.45 0.63 -1.26 -4.96 116.66 112.67 1ibm n ARG 26 Ca 0.32 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.25 1ibm n ARG 26 Cb 1.20 -0.34 0.00 0.00 0.45 0.00 0.00 32.46 33.77 1ibm n ARG 26 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ibm n GLY 28 N 2.86 0.42 3.41 0.00 0.00 -1.16 -4.90 105.19 105.81 1ibm n GLY 28 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.51 1ibm n GLY 28 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ibm n ARG 29 N -2.00 0.67 -0.20 1.61 3.00 -1.26 -3.56 116.66 114.93 1ibm n ARG 29 Ca 0.00 0.16 -0.05 0.00 -0.00 0.00 0.00 57.85 57.97 1ibm n ARG 29 Cb 0.00 -2.17 0.13 0.00 0.00 0.00 0.00 32.46 30.42 1ibm n ARG 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ibm h ALA 30 N 11.95 1.11 -2.17 5.13 0.00 -1.95 -2.99 119.26 130.34 1ibm h ALA 30 Ca -0.20 -0.22 -0.46 0.00 0.00 0.00 0.00 54.91 54.04 1ibm h ALA 30 Cb 1.34 -0.25 0.09 0.00 0.00 0.00 0.00 17.79 18.97 1ibm h ALA 30 CO 1.09 0.60 0.26 1.03 0.00 0.00 0.00 179.25 182.23 1ibm s ARG 31 N -5.30 1.87 -0.02 0.00 0.52 -1.26 -4.33 118.95 110.42 1ibm s ARG 31 Ca -0.11 -0.35 -0.00 0.00 -0.52 0.00 0.00 55.73 54.75 1ibm s ARG 31 Cb 0.15 -2.12 0.00 0.00 0.52 0.00 0.00 34.95 33.51 1ibm s ARG 31 CO 0.82 -1.48 0.01 -1.13 0.02 0.00 0.00 175.30 173.54 1ibm n SER 32 N -3.08 -0.95 -4.56 0.23 3.41 -1.26 -4.58 113.62 102.83 1ibm n SER 32 Ca 0.10 0.45 -0.40 0.00 -0.26 0.00 0.00 58.87 58.76 1ibm n SER 32 Cb 0.60 -0.94 -0.03 0.00 -0.26 0.00 0.00 64.21 63.58 1ibm n SER 32 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1ibm s VAL 33 N -1.89 3.81 0.86 -3.33 -7.23 -1.26 -1.68 120.40 109.68 1ibm s VAL 33 Ca 0.01 -0.40 -0.12 0.00 -1.81 0.00 0.00 61.98 59.66 1ibm s VAL 33 Cb -0.01 -4.90 0.09 0.00 0.56 0.00 0.00 36.38 32.13 1ibm s VAL 33 CO 0.01 -1.80 1.00 -1.22 -0.31 0.00 0.00 175.10 172.78 1ibm n TYR 34 N 9.58 0.52 -0.07 2.82 4.02 -0.34 -4.92 117.16 128.77 1ibm n TYR 34 Ca 0.26 0.37 -0.04 0.00 -0.01 0.00 0.00 57.90 58.47 1ibm n TYR 34 Cb 0.50 -2.00 -0.02 0.00 -0.02 0.00 0.00 39.34 37.80 1ibm n TYR 34 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1ibm h ARG 35 N -1.31 0.00 -2.00 -0.72 3.08 -1.95 -3.14 114.38 108.33 1ibm h ARG 35 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 1ibm h ARG 35 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 1ibm h ARG 35 CO 0.42 0.03 0.00 0.34 -1.07 0.00 0.00 179.97 179.69 1ibm n PHE 36 N -4.64 0.00 0.00 3.04 -0.00 -1.26 -2.12 117.46 112.49 1ibm n PHE 36 Ca -0.07 -0.09 0.00 0.00 -0.00 0.00 0.00 57.45 57.29 1ibm n PHE 36 Cb 0.24 -0.27 0.00 0.00 -0.00 0.00 0.00 39.48 39.45 1ibm n PHE 36 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1ibm n PHE 37 N 1.92 0.00 -0.58 -5.13 0.99 -1.26 -4.96 117.46 108.44 1ibm n PHE 37 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1ibm n PHE 37 Cb 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.53 1ibm n PHE 37 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ibm n GLY 38 N -0.19 0.79 3.93 1.37 0.00 -0.90 -4.94 105.19 105.25 1ibm n GLY 38 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1ibm n GLY 38 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ibm s LEU 39 N 0.00 4.01 0.39 0.99 1.43 -1.25 -1.71 118.68 122.54 1ibm s LEU 39 Ca 0.00 0.53 -0.02 0.00 -1.03 0.00 0.00 54.13 53.60 1ibm s LEU 39 Cb 0.00 -3.38 -0.04 0.00 0.03 0.00 0.00 46.19 42.80 1ibm s LEU 39 CO 0.00 -0.28 0.64 0.00 0.23 0.00 0.00 176.35 176.94 1ibm h ARG 41 N 0.71 0.08 0.01 0.00 -0.00 -1.57 0.08 114.38 113.69 1ibm h ARG 41 Ca -0.48 -0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.49 1ibm h ARG 41 Cb 1.21 -0.02 0.00 0.00 -0.00 0.00 0.00 29.97 31.16 1ibm h ARG 41 CO 0.62 0.05 -0.01 0.82 -0.00 0.00 0.00 179.97 181.46 1ibm h ILE 42 N 0.08 1.54 -0.21 0.08 2.04 -1.93 -3.29 117.51 115.82 1ibm h ILE 42 Ca 0.53 -1.98 0.03 0.00 1.00 0.00 0.00 64.86 64.43 1ibm h ILE 42 Cb 1.94 2.83 -0.03 0.00 -0.74 0.00 0.00 36.82 40.83 1ibm h ILE 42 CO -0.06 0.49 0.02 0.00 0.00 0.00 0.00 178.15 178.60 1ibm h LEU 44 N 0.10 -0.55 -0.19 0.00 5.85 -1.18 -0.97 115.31 118.38 1ibm h LEU 44 Ca 0.10 0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.99 1ibm h LEU 44 Cb 0.11 0.39 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1ibm h LEU 44 CO -0.15 -0.21 0.01 -0.09 -0.34 0.00 0.00 178.44 177.66 1ibm h ARG 45 N 0.02 0.33 0.06 1.25 2.43 -1.45 0.23 114.38 117.26 1ibm h ARG 45 Ca 0.33 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 1ibm h ARG 45 Cb 0.52 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1ibm h ARG 45 CO -0.67 0.52 -0.16 0.93 -1.51 0.00 0.00 179.97 179.09 1ibm h GLU 46 N 0.09 -0.24 -0.96 0.20 5.08 -0.20 0.20 114.58 118.76 1ibm h GLU 46 Ca 0.05 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.53 1ibm h GLU 46 Cb 0.37 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.60 1ibm h GLU 46 CO 0.01 -0.16 0.61 -0.07 -1.00 0.00 0.00 179.01 178.40 1ibm h LEU 47 N -0.25 0.90 -1.25 1.33 3.38 -1.28 0.13 115.31 118.28 1ibm h LEU 47 Ca -0.01 0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.05 1ibm h LEU 47 Cb 0.24 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 1ibm h LEU 47 CO -0.07 0.53 0.54 0.00 0.09 0.00 0.00 178.44 179.53 1ibm h ALA 48 N 1.52 1.59 -0.33 1.53 0.00 -0.03 -1.22 119.26 122.33 1ibm h ALA 48 Ca 0.44 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 55.19 1ibm h ALA 48 Cb 0.37 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ibm h ALA 48 CO -0.20 0.29 -0.33 0.45 0.00 0.00 0.00 179.25 179.45 1ibm h HIS 49 N 0.91 0.96 -0.67 0.00 3.86 0.20 -3.13 115.15 117.29 1ibm h HIS 49 Ca 0.35 -0.29 0.04 0.00 -1.16 0.00 0.00 60.37 59.32 1ibm h HIS 49 Cb 0.21 -0.20 -0.05 0.00 1.06 0.00 0.00 27.41 28.44 1ibm h HIS 49 CO -0.00 1.07 0.40 0.87 0.86 0.00 0.00 177.93 181.13 1ibm h LYS 50 N 0.57 0.74 0.00 2.45 1.57 -0.26 -3.46 116.57 118.18 1ibm h LYS 50 Ca 0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1ibm h LYS 50 Cb 0.91 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1ibm h LYS 50 CO 0.08 0.49 0.00 0.41 -0.57 0.00 0.00 179.45 179.86 1ibm n GLY 51 N -1.28 1.09 0.00 3.86 0.00 -0.58 -5.00 105.19 103.28 1ibm n GLY 51 Ca 0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.16 1ibm n GLY 51 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ibm n GLN 52 N 0.00 0.06 -3.19 1.61 6.02 -1.14 -4.34 117.38 116.40 1ibm n GLN 52 Ca 0.00 0.24 -0.45 0.00 -0.01 0.00 0.00 57.00 56.78 1ibm n GLN 52 Cb 0.00 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 29.72 1ibm n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1ibm s LEU 53 N -2.87 5.75 0.16 1.08 1.43 -1.26 -5.02 118.68 117.97 1ibm s LEU 53 Ca 0.08 -1.67 -0.33 0.00 -1.03 0.00 0.00 54.13 51.18 1ibm s LEU 53 Cb 0.08 -2.27 -0.15 0.00 0.03 0.00 0.00 46.19 43.88 1ibm s LEU 53 CO 0.22 -0.99 1.25 -0.81 0.23 0.00 0.00 176.35 176.25 1ibm n PRO 54 N 5.80 1.32 0.00 1.29 -0.04 -1.26 -1.67 135.00 140.44 1ibm n PRO 54 Ca -0.08 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.85 1ibm n PRO 54 Cb 0.42 -2.03 0.00 0.00 -0.04 0.00 0.00 33.50 31.85 1ibm n PRO 54 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ibm n GLY 55 N 2.20 0.90 3.67 0.55 0.00 -1.26 -4.90 105.19 106.35 1ibm n GLY 55 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1ibm n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ibm s VAL 56 N 0.00 3.09 0.02 1.61 1.01 -0.67 -4.96 120.40 120.49 1ibm s VAL 56 Ca 0.00 0.32 -0.03 0.00 0.00 0.00 0.00 61.98 62.27 1ibm s VAL 56 Cb 0.00 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.16 1ibm s VAL 56 CO 0.00 -0.02 0.03 -0.60 0.00 0.00 0.00 175.10 174.52 1ibm s ARG 57 N 3.62 0.41 -0.39 2.72 3.52 -1.26 -4.81 118.95 122.76 1ibm s ARG 57 Ca 0.80 -0.60 -0.40 0.00 -0.13 0.00 0.00 55.73 55.39 1ibm s ARG 57 Cb -0.40 0.16 -0.15 0.00 -1.56 0.00 0.00 34.95 32.99 1ibm s ARG 57 CO 0.35 -0.08 2.01 1.63 -0.81 0.00 0.00 175.30 178.39 1ibm n LYS 58 N 1.36 0.68 -1.80 5.12 4.76 -1.26 -4.90 118.16 122.12 1ibm n LYS 58 Ca -0.22 0.21 -0.30 0.00 -2.87 0.00 0.00 58.31 55.13 1ibm n LYS 58 Cb 0.56 -2.00 0.05 0.00 -1.84 0.00 0.00 35.03 31.80 1ibm n LYS 58 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ibm s ALA 59 N 5.55 2.79 0.00 7.82 0.00 -1.26 -5.09 121.76 131.57 1ibm s ALA 59 Ca 1.09 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.79 1ibm s ALA 59 Cb -1.16 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 18.90 1ibm s ALA 59 CO 0.61 -1.20 0.00 0.45 0.00 0.00 0.00 175.76 175.63 1ibm n SER 60 N -3.06 0.00 0.00 0.00 2.88 -1.26 -5.34 113.62 106.83 1ibm n SER 60 Ca 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 1ibm n SER 60 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 1ibm n SER 60 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14