#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a75 n GLY 4 N 0.00 0.47 0.19 0.00 0.00 0.29 -4.28 105.19 101.86 1a75 n GLY 4 Ca 0.00 -0.69 0.03 0.00 0.00 0.00 0.00 46.02 45.36 1a75 n GLY 4 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1a75 h ILE 5 N 0.00 1.23 -0.83 -0.61 2.10 -1.78 -2.25 117.51 115.37 1a75 h ILE 5 Ca 0.00 -1.19 -0.34 0.00 1.08 0.00 0.00 64.86 64.41 1a75 h ILE 5 Cb 0.00 1.64 -0.20 0.00 -1.09 0.00 0.00 36.82 37.17 1a75 h ILE 5 CO 0.00 0.34 0.42 0.18 -1.08 0.00 0.00 178.15 178.00 1a75 n LEU 6 N -4.10 6.27 -4.74 2.19 4.77 -0.50 -5.00 117.00 115.89 1a75 n LEU 6 Ca -0.02 -3.41 -0.41 0.00 -0.03 0.00 0.00 56.01 52.14 1a75 n LEU 6 Cb 0.39 -0.78 -0.05 0.00 -2.33 0.00 0.00 43.42 40.65 1a75 n LEU 6 CO 0.38 0.93 0.67 0.00 -1.33 0.00 0.00 177.39 178.04 1a75 s ALA 7 N -3.14 3.29 0.16 -1.18 0.00 -0.85 -4.74 121.76 115.30 1a75 s ALA 7 Ca 0.55 0.61 -0.13 0.00 0.00 0.00 0.00 51.96 52.99 1a75 s ALA 7 Cb 0.46 -3.26 0.01 0.00 0.00 0.00 0.00 23.12 20.33 1a75 s ALA 7 CO 0.12 0.05 0.38 0.16 0.00 0.00 0.00 175.76 176.47 1a75 s ASP 8 N -0.46 -0.11 0.20 0.00 1.47 -1.26 -5.02 116.67 111.49 1a75 s ASP 8 Ca 0.45 -0.60 -0.19 0.00 1.18 0.00 0.00 52.55 53.39 1a75 s ASP 8 Cb -0.25 0.48 0.15 0.00 -0.34 0.00 0.00 42.92 42.97 1a75 s ASP 8 CO 0.31 -0.92 1.58 0.00 0.68 0.00 0.00 175.17 176.83 1a75 h ALA 9 N 2.41 0.04 0.79 2.11 0.00 -1.98 0.40 119.26 123.03 1a75 h ALA 9 Ca -0.31 0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1a75 h ALA 9 Cb 1.24 0.78 0.00 0.00 0.00 0.00 0.00 17.79 19.82 1a75 h ALA 9 CO 0.45 -0.64 -0.41 -0.44 0.00 0.00 0.00 179.25 178.21 1a75 h ASP 10 N -0.13 -0.99 0.56 0.00 3.32 -1.98 0.55 116.42 117.75 1a75 h ASP 10 Ca 0.26 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.32 1a75 h ASP 10 Cb 0.55 0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.37 1a75 h ASP 10 CO -0.72 -0.67 -0.12 0.00 -1.72 0.00 0.00 179.24 176.00 1a75 h ALA 12 N 1.88 0.47 -0.15 0.00 0.00 0.12 -2.01 119.26 119.56 1a75 h ALA 12 Ca -0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1a75 h ALA 12 Cb 0.43 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1a75 h ALA 12 CO 0.02 0.38 0.02 0.00 0.00 0.00 0.00 179.25 179.67 1a75 h ALA 13 N 0.78 1.76 -0.21 0.00 0.00 0.63 -0.32 119.26 121.89 1a75 h ALA 13 Ca 0.07 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1a75 h ALA 13 Cb 0.70 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1a75 h ALA 13 CO 0.05 0.19 -0.41 0.00 0.00 0.00 0.00 179.25 179.08 1a75 h ALA 14 N 1.82 0.33 0.38 0.00 0.00 -0.65 -2.15 119.26 118.99 1a75 h ALA 14 Ca 0.05 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1a75 h ALA 14 Cb 0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1a75 h ALA 14 CO -0.00 0.44 -0.25 0.28 0.00 0.00 0.00 179.25 179.72 1a75 h VAL 15 N 0.34 0.48 -1.03 0.00 2.07 -0.89 -1.28 116.25 115.95 1a75 h VAL 15 Ca 0.01 0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.81 1a75 h VAL 15 Cb 1.01 0.48 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 1a75 h VAL 15 CO 0.09 0.00 0.71 0.50 0.02 0.00 0.00 177.57 178.89 1a75 h LYS 16 N -0.61 0.18 0.00 1.57 3.11 -1.09 -1.47 116.57 118.26 1a75 h LYS 16 Ca -0.04 -0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 57.77 1a75 h LYS 16 Cb 0.51 -0.04 -0.00 0.00 -1.00 0.00 0.00 32.23 31.70 1a75 h LYS 16 CO 0.03 0.12 -0.08 0.00 -2.81 0.00 0.00 179.45 176.72 1a75 h ALA 17 N 1.54 0.99 -0.81 5.00 0.00 -0.53 -3.04 119.26 122.41 1a75 h ALA 17 Ca 0.53 -0.07 -0.55 0.00 0.00 0.00 0.00 54.91 54.82 1a75 h ALA 17 Cb 1.72 -0.01 -0.43 0.00 0.00 0.00 0.00 17.79 19.07 1a75 h ALA 17 CO -0.13 0.10 -0.82 0.00 0.00 0.00 0.00 179.25 178.40 1a75 h GLU 19 N 2.22 0.57 -6.83 0.00 5.08 -1.41 -3.43 114.58 110.78 1a75 h GLU 19 Ca 0.36 -0.05 -0.48 0.00 -1.00 0.00 0.00 59.36 58.19 1a75 h GLU 19 Cb 1.49 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.59 1a75 h GLU 19 CO 0.76 0.43 0.26 0.00 -1.00 0.00 0.00 179.01 179.46 1a75 s ALA 20 N -5.40 3.23 0.30 3.43 0.00 -1.26 -4.91 121.76 117.15 1a75 s ALA 20 Ca -0.08 0.37 -0.30 0.00 0.00 0.00 0.00 51.96 51.95 1a75 s ALA 20 Cb 0.17 -3.05 -0.11 0.00 0.00 0.00 0.00 23.12 20.13 1a75 s ALA 20 CO 0.74 0.22 1.55 0.00 0.00 0.00 0.00 175.76 178.27 1a75 s ALA 21 N -1.74 3.70 -0.71 0.00 0.00 -1.26 -2.62 121.76 119.12 1a75 s ALA 21 Ca 0.51 1.53 -0.00 0.00 0.00 0.00 0.00 51.96 54.00 1a75 s ALA 21 Cb -0.15 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.34 1a75 s ALA 21 CO 0.20 -0.95 0.02 -0.25 0.00 0.00 0.00 175.76 174.78 1a75 n ASP 22 N 1.90 -3.01 -0.17 0.00 8.00 -1.26 -4.92 116.55 117.09 1a75 n ASP 22 Ca 0.07 -0.02 0.05 0.00 0.71 0.00 0.00 54.79 55.60 1a75 n ASP 22 Cb 0.38 -2.29 -0.02 0.00 -0.02 0.00 0.00 41.12 39.18 1a75 n ASP 22 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1a75 n SER 23 N 0.36 1.03 -4.79 -2.24 3.41 -1.08 -5.02 113.62 105.30 1a75 n SER 23 Ca -0.10 -1.02 -0.39 0.00 -0.26 0.00 0.00 58.87 57.11 1a75 n SER 23 Cb 0.57 0.63 -0.06 0.00 -0.26 0.00 0.00 64.21 65.09 1a75 n SER 23 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1a75 s PHE 24 N -1.59 3.87 -0.06 7.33 5.36 -1.26 -4.83 117.98 126.80 1a75 s PHE 24 Ca 0.07 1.49 -0.03 0.00 -0.96 0.00 0.00 56.93 57.50 1a75 s PHE 24 Cb 0.08 -2.66 0.03 0.00 -0.34 0.00 0.00 43.02 40.14 1a75 s PHE 24 CO 0.32 0.54 0.14 -1.54 -1.46 0.00 0.00 175.22 173.22 1a75 s SER 25 N -1.12 -0.11 0.47 6.13 1.04 -1.26 -4.98 113.70 113.87 1a75 s SER 25 Ca 0.33 0.28 0.16 0.00 0.48 0.00 0.00 55.95 57.20 1a75 s SER 25 Cb -0.22 0.20 1.10 0.00 0.10 0.00 0.00 66.02 67.20 1a75 s SER 25 CO 0.23 -0.12 2.04 0.10 0.98 0.00 0.00 173.24 176.47 1a75 h TYR 26 N 6.95 0.00 -0.26 5.02 -0.00 -1.97 -2.05 116.97 124.66 1a75 h TYR 26 Ca -0.39 0.00 -0.06 0.00 -0.00 0.00 0.00 58.73 58.28 1a75 h TYR 26 Cb 1.15 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.88 1a75 h TYR 26 CO 0.43 0.13 -0.07 0.87 -0.00 0.00 0.00 178.16 179.52 1a75 h LYS 27 N 0.00 0.50 -0.67 0.10 1.79 -1.96 -2.13 116.57 114.20 1a75 h LYS 27 Ca -0.00 -0.19 -0.05 0.00 -2.18 0.00 0.00 60.65 58.22 1a75 h LYS 27 Cb 0.24 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.83 1a75 h LYS 27 CO 0.02 0.72 0.21 0.00 -1.08 0.00 0.00 179.45 179.32 1a75 h ALA 28 N 0.76 0.88 0.37 3.86 0.00 -1.85 -1.40 119.26 121.88 1a75 h ALA 28 Ca 0.06 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1a75 h ALA 28 Cb 0.54 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1a75 h ALA 28 CO 0.03 0.55 -0.34 0.35 0.00 0.00 0.00 179.25 179.83 1a75 h PHE 29 N 0.97 -0.93 0.00 0.00 3.04 -1.32 -2.91 116.94 115.80 1a75 h PHE 29 Ca 0.22 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.15 1a75 h PHE 29 Cb 0.29 0.36 -0.00 0.00 2.56 0.00 0.00 35.95 39.16 1a75 h PHE 29 CO 0.02 -0.49 -0.10 0.74 -2.02 0.00 0.00 178.31 176.46 1a75 h PHE 30 N -0.73 0.00 -0.26 0.41 0.04 -1.28 0.61 116.94 115.73 1a75 h PHE 30 Ca -0.03 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.69 1a75 h PHE 30 Cb 0.65 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.79 1a75 h PHE 30 CO -0.19 0.10 -0.09 0.00 -0.60 0.00 0.00 178.31 177.53 1a75 h ALA 31 N 1.90 1.38 0.00 2.45 0.00 -1.07 -3.27 119.26 120.65 1a75 h ALA 31 Ca -0.00 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.53 1a75 h ALA 31 Cb 0.55 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1a75 h ALA 31 CO 0.01 0.43 -0.86 -0.22 0.00 0.00 0.00 179.25 178.61 1a75 h LYS 32 N 0.39 0.00 -6.18 0.00 3.64 -0.97 -3.41 116.57 110.03 1a75 h LYS 32 Ca 0.08 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.88 1a75 h LYS 32 Cb 0.40 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.13 1a75 h LYS 32 CO 0.02 0.95 1.35 0.00 -2.27 0.00 0.00 179.45 179.50 1a75 n GLY 34 N 6.37 1.31 0.17 0.00 0.00 -1.25 -4.47 105.19 107.32 1a75 n GLY 34 Ca 0.23 -0.18 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 1a75 n GLY 34 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1a75 h LEU 35 N 5.94 0.49 -1.98 0.99 6.46 -1.91 -2.94 115.31 122.37 1a75 h LEU 35 Ca 0.03 -0.32 0.24 0.00 -0.12 0.00 0.00 57.88 57.72 1a75 h LEU 35 Cb 0.22 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 39.98 1a75 h LEU 35 CO 0.48 0.69 0.63 0.77 -0.62 0.00 0.00 178.44 180.39 1a75 h SER 36 N 0.29 0.00 0.44 1.25 4.64 -1.78 0.26 113.55 118.65 1a75 h SER 36 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1a75 h SER 36 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1a75 h SER 36 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 1a75 n GLY 37 N -1.69 -1.01 3.95 -0.77 0.00 -1.11 -4.84 105.19 99.73 1a75 n GLY 37 Ca 0.17 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 1a75 n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a75 s LYS 38 N -2.65 1.92 0.63 1.61 1.02 0.08 -5.05 119.74 117.31 1a75 s LYS 38 Ca 0.18 -0.53 -0.18 0.00 0.02 0.00 0.00 55.97 55.46 1a75 s LYS 38 Cb 0.14 -2.20 -0.01 0.00 -0.52 0.00 0.00 37.83 35.23 1a75 s LYS 38 CO 0.32 -1.37 1.21 -1.54 -0.92 0.00 0.00 175.35 173.05 1a75 s SER 39 N -4.60 4.90 0.49 2.83 1.04 -1.26 -4.76 113.70 112.33 1a75 s SER 39 Ca 0.63 2.39 0.15 0.00 0.48 0.00 0.00 55.95 59.60 1a75 s SER 39 Cb -0.09 -2.60 1.18 0.00 0.10 0.00 0.00 66.02 64.62 1a75 s SER 39 CO 0.45 -1.79 2.09 0.00 0.98 0.00 0.00 173.24 174.97 1a75 h ALA 40 N 0.54 2.01 -0.38 5.32 0.00 -1.96 0.34 119.26 125.12 1a75 h ALA 40 Ca -0.50 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.30 1a75 h ALA 40 Cb 1.30 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1a75 h ALA 40 CO 0.54 -0.05 -0.15 -0.44 0.00 0.00 0.00 179.25 179.15 1a75 h ASP 41 N 0.15 0.80 0.92 0.00 3.32 -1.99 -2.13 116.42 117.49 1a75 h ASP 41 Ca 0.09 -0.39 -0.08 0.00 0.02 0.00 0.00 57.03 56.67 1a75 h ASP 41 Cb 0.17 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1a75 h ASP 41 CO -0.01 1.01 -0.37 0.44 -1.72 0.00 0.00 179.24 178.59 1a75 h ASP 42 N 0.58 0.00 0.30 6.45 5.19 -1.26 -0.83 116.42 126.84 1a75 h ASP 42 Ca 0.09 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.26 1a75 h ASP 42 Cb 0.69 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.21 1a75 h ASP 42 CO 0.05 0.37 -1.02 0.40 -3.12 0.00 0.00 179.24 175.92 1a75 h ILE 43 N 0.00 1.38 -0.39 0.35 2.04 -0.34 -3.02 117.51 117.52 1a75 h ILE 43 Ca -0.00 -2.48 -0.11 0.00 1.00 0.00 0.00 64.86 63.26 1a75 h ILE 43 Cb 0.92 2.49 -0.02 0.00 -0.74 0.00 0.00 36.82 39.48 1a75 h ILE 43 CO 0.05 0.74 -0.19 0.50 0.00 0.00 0.00 178.15 179.25 1a75 h LYS 44 N 0.24 0.76 -0.93 2.37 3.64 -1.16 -2.68 116.57 118.81 1a75 h LYS 44 Ca -0.10 -0.29 0.01 0.00 -1.27 0.00 0.00 60.65 59.00 1a75 h LYS 44 Cb 1.67 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.40 1a75 h LYS 44 CO 0.18 0.89 0.62 0.87 -2.27 0.00 0.00 179.45 179.74 1a75 h LYS 45 N 0.67 1.22 -0.87 1.90 1.57 -1.18 -0.49 116.57 119.39 1a75 h LYS 45 Ca 0.10 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1a75 h LYS 45 Cb 0.69 -0.28 -0.04 0.00 0.08 0.00 0.00 32.23 32.68 1a75 h LYS 45 CO 0.05 0.81 0.49 0.00 -0.57 0.00 0.00 179.45 180.23 1a75 h ALA 46 N 1.34 1.12 -0.27 3.86 0.00 -1.39 -0.12 119.26 123.80 1a75 h ALA 46 Ca 0.34 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.17 1a75 h ALA 46 Cb -0.14 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.27 1a75 h ALA 46 CO -0.08 0.61 0.03 0.35 0.00 0.00 0.00 179.25 180.16 1a75 h PHE 47 N 1.21 0.04 0.00 0.00 3.57 -0.92 -1.67 116.94 119.17 1a75 h PHE 47 Ca 0.31 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.75 1a75 h PHE 47 Cb 0.01 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1a75 h PHE 47 CO 0.01 -0.01 -0.37 -0.39 -2.23 0.00 0.00 178.31 175.32 1a75 h VAL 48 N 0.12 1.04 -0.49 1.41 -1.51 -0.75 -0.28 116.25 115.78 1a75 h VAL 48 Ca 0.13 -1.37 -0.00 0.00 -1.23 0.00 0.00 66.70 64.23 1a75 h VAL 48 Cb 0.15 1.79 -0.02 0.00 -2.13 0.00 0.00 31.29 31.07 1a75 h VAL 48 CO -0.19 0.36 0.29 -0.26 -1.23 0.00 0.00 177.57 176.54 1a75 h PHE 49 N 0.00 0.66 -0.03 5.19 -1.00 -0.51 -3.15 116.94 118.11 1a75 h PHE 49 Ca -0.00 -0.01 -0.18 0.00 2.81 0.00 0.00 57.97 60.59 1a75 h PHE 49 Cb 0.76 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 40.09 1a75 h PHE 49 CO 0.00 0.47 -0.77 0.82 -1.61 0.00 0.00 178.31 177.21 1a75 h ILE 50 N 0.66 1.45 0.00 -0.55 2.04 -0.83 -3.34 117.51 116.93 1a75 h ILE 50 Ca 0.18 -2.36 -0.40 0.00 1.00 0.00 0.00 64.86 63.27 1a75 h ILE 50 Cb 0.01 2.28 0.03 0.00 -0.74 0.00 0.00 36.82 38.40 1a75 h ILE 50 CO -0.03 0.69 2.14 -0.67 0.00 0.00 0.00 178.15 180.28 1a75 n ASP 51 N -3.75 3.09 0.09 1.72 2.03 -0.16 -4.74 116.55 114.83 1a75 n ASP 51 Ca -0.03 -2.37 0.15 0.00 0.52 0.00 0.00 54.79 53.05 1a75 n ASP 51 Cb 0.73 -0.95 0.66 0.00 -0.72 0.00 0.00 41.12 40.85 1a75 n ASP 51 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1a75 h GLN 52 N 7.34 0.03 -0.16 -0.67 4.20 -1.78 0.58 115.11 124.64 1a75 h GLN 52 Ca 0.37 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.08 1a75 h GLN 52 Cb 0.31 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.08 1a75 h GLN 52 CO 1.55 0.02 0.00 -0.40 -0.67 0.00 0.00 178.83 179.33 1a75 n ASP 53 N -4.45 1.75 -3.64 1.46 5.75 -1.26 -4.95 116.55 111.21 1a75 n ASP 53 Ca 0.05 -1.71 -0.24 0.00 -0.01 0.00 0.00 54.79 52.88 1a75 n ASP 53 Cb 0.40 -0.10 0.07 0.00 -1.03 0.00 0.00 41.12 40.45 1a75 n ASP 53 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1a75 n LYS 54 N 0.38 -7.32 0.07 0.11 4.01 0.19 -4.88 118.16 110.73 1a75 n LYS 54 Ca 0.16 0.78 0.13 0.00 -0.51 0.00 0.00 58.31 58.88 1a75 n LYS 54 Cb 0.35 -5.79 0.33 0.00 -0.51 0.00 0.00 35.03 29.40 1a75 n LYS 54 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1a75 n SER 55 N -3.00 0.69 0.00 4.39 3.41 -1.26 -4.88 113.62 112.97 1a75 n SER 55 Ca -0.03 0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.94 1a75 n SER 55 Cb 0.57 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1a75 n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a75 n GLY 56 N 1.35 0.79 3.02 5.00 0.00 -1.26 -5.04 105.19 109.05 1a75 n GLY 56 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 1a75 n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a75 s PHE 57 N -2.61 0.51 -0.28 1.61 0.40 -1.26 -4.55 117.98 111.80 1a75 s PHE 57 Ca 0.00 -0.46 -0.15 0.00 -0.60 0.00 0.00 56.93 55.72 1a75 s PHE 57 Cb 0.00 -0.32 -0.03 0.00 0.51 0.00 0.00 43.02 43.18 1a75 s PHE 57 CO 0.00 -0.11 0.39 0.42 0.70 0.00 0.00 175.22 176.62 1a75 s ILE 58 N -1.26 5.16 0.47 0.64 1.01 -0.17 -4.78 121.20 122.26 1a75 s ILE 58 Ca -0.11 0.52 -0.01 0.00 0.00 0.00 0.00 60.65 61.05 1a75 s ILE 58 Cb -0.09 -3.74 -0.00 0.00 0.01 0.00 0.00 42.46 38.64 1a75 s ILE 58 CO -0.00 0.10 0.71 -1.61 0.00 0.00 0.00 174.94 174.14 1a75 s GLU 59 N 2.10 3.06 0.55 2.79 8.01 -1.26 -1.12 118.70 132.84 1a75 s GLU 59 Ca 0.15 -0.40 0.26 0.00 0.01 0.00 0.00 54.97 55.00 1a75 s GLU 59 Cb -0.16 -2.51 1.47 0.00 -4.31 0.00 0.00 34.13 28.62 1a75 s GLU 59 CO 0.10 -0.33 2.03 0.93 0.01 0.00 0.00 175.26 178.00 1a75 h GLU 60 N 0.31 0.00 -0.09 1.61 5.08 -1.97 -0.41 114.58 119.12 1a75 h GLU 60 Ca -0.46 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 57.77 1a75 h GLU 60 Cb 1.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1a75 h GLU 60 CO 0.58 0.00 -0.52 0.38 -1.00 0.00 0.00 179.01 178.45 1a75 h ASP 61 N 0.00 0.26 0.71 1.42 2.03 -1.97 -1.52 116.42 117.36 1a75 h ASP 61 Ca 0.18 -0.13 -0.26 0.00 -0.73 0.00 0.00 57.03 56.09 1a75 h ASP 61 Cb 0.80 -0.08 -0.01 0.00 -0.83 0.00 0.00 39.33 39.22 1a75 h ASP 61 CO -0.00 0.74 -1.22 -0.33 -1.03 0.00 0.00 179.24 177.40 1a75 h GLU 62 N 0.19 0.18 -0.90 4.15 5.08 -1.45 -3.18 114.58 118.66 1a75 h GLU 62 Ca 0.01 -0.32 0.10 0.00 -1.00 0.00 0.00 59.36 58.15 1a75 h GLU 62 Cb 0.98 0.12 -0.07 0.00 0.50 0.00 0.00 28.75 30.27 1a75 h GLU 62 CO 0.08 1.13 0.54 -0.07 -1.00 0.00 0.00 179.01 179.69 1a75 h LEU 63 N 0.05 0.80 -1.30 1.33 3.38 -0.96 -0.45 115.31 118.16 1a75 h LEU 63 Ca -0.11 0.04 0.23 0.00 0.09 0.00 0.00 57.88 58.13 1a75 h LEU 63 Cb 1.92 -0.12 -0.09 0.00 0.09 0.00 0.00 40.66 42.46 1a75 h LEU 63 CO 0.18 0.46 0.64 0.50 0.09 0.00 0.00 178.44 180.30 1a75 h LYS 64 N 0.91 0.48 -0.71 1.13 3.64 -1.26 -1.49 116.57 119.27 1a75 h LYS 64 Ca 0.43 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 1a75 h LYS 64 Cb 0.36 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1a75 h LYS 64 CO -0.24 0.32 0.00 1.28 -2.27 0.00 0.00 179.45 178.54 1a75 n LEU 65 N -4.64 4.13 -0.27 5.20 4.77 -0.19 -0.52 117.00 125.47 1a75 n LEU 65 Ca 0.23 -2.07 0.07 0.00 -0.03 0.00 0.00 56.01 54.22 1a75 n LEU 65 Cb 0.76 -0.51 0.22 0.00 -2.33 0.00 0.00 43.42 41.55 1a75 n LEU 65 CO 0.25 0.92 1.02 0.15 -1.33 0.00 0.00 177.39 178.40 1a75 h PHE 66 N 4.18 0.54 -0.79 -1.77 3.57 -1.07 -2.10 116.94 119.50 1a75 h PHE 66 Ca 0.00 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 1a75 h PHE 66 Cb 1.11 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.70 1a75 h PHE 66 CO 0.57 0.03 0.37 -0.07 -2.23 0.00 0.00 178.31 176.98 1a75 h LEU 67 N 0.43 1.03 -2.20 0.59 4.07 -1.81 -2.78 115.31 114.64 1a75 h LEU 67 Ca 0.45 -0.12 -0.01 0.00 0.08 0.00 0.00 57.88 58.28 1a75 h LEU 67 Cb 0.74 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 42.22 1a75 h LEU 67 CO -0.44 0.88 -0.06 1.56 -1.08 0.00 0.00 178.44 179.29 1a75 h GLN 68 N 1.13 0.00 -0.12 1.13 4.20 -1.53 -1.15 115.11 118.76 1a75 h GLN 68 Ca 0.27 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.92 1a75 h GLN 68 Cb 0.12 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1a75 h GLN 68 CO -0.03 0.06 -0.22 0.28 -0.67 0.00 0.00 178.83 178.25 1a75 h VAL 69 N 0.00 1.21 0.00 -0.54 2.07 -1.52 0.86 116.25 118.33 1a75 h VAL 69 Ca -0.00 -0.99 -0.00 0.00 0.82 0.00 0.00 66.70 66.53 1a75 h VAL 69 Cb 0.17 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1a75 h VAL 69 CO 0.01 0.30 -1.60 0.49 0.02 0.00 0.00 177.57 176.79 1a75 n PHE 70 N -4.20 0.40 -3.63 1.57 3.72 -0.51 -1.41 117.46 113.38 1a75 n PHE 70 Ca -0.01 0.12 -0.14 0.00 -0.05 0.00 0.00 57.45 57.36 1a75 n PHE 70 Cb 0.33 -0.69 -0.07 0.00 -0.94 0.00 0.00 39.48 38.11 1a75 n PHE 70 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1a75 s LYS 71 N -3.45 0.81 0.18 -1.08 2.47 -0.73 -3.69 119.74 114.25 1a75 s LYS 71 Ca -0.05 0.81 -0.31 0.00 -1.56 0.00 0.00 55.97 54.86 1a75 s LYS 71 Cb 0.12 0.39 -0.10 0.00 -1.46 0.00 0.00 37.83 36.79 1a75 s LYS 71 CO 0.86 -0.13 1.53 0.00 0.16 0.00 0.00 175.35 177.77 1a75 s ALA 72 N 0.11 3.73 0.00 3.13 0.00 -1.26 -2.58 121.76 124.90 1a75 s ALA 72 Ca -0.02 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.29 1a75 s ALA 72 Cb -0.04 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.48 1a75 s ALA 72 CO 0.02 -0.76 0.00 0.41 0.00 0.00 0.00 175.76 175.43 1a75 n GLY 73 N 3.32 0.54 3.70 0.00 0.00 -1.26 -4.98 105.19 106.51 1a75 n GLY 73 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 1a75 n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a75 s ALA 74 N -2.26 1.78 0.46 4.61 0.00 -1.06 -4.99 121.76 120.31 1a75 s ALA 74 Ca 0.00 0.69 -0.19 0.00 0.00 0.00 0.00 51.96 52.46 1a75 s ALA 74 Cb 0.00 -3.45 -0.10 0.00 0.00 0.00 0.00 23.12 19.57 1a75 s ALA 74 CO 0.00 -2.35 0.97 -0.98 0.00 0.00 0.00 175.76 173.40 1a75 s ARG 75 N -4.38 4.10 0.56 0.00 1.70 -1.26 -4.74 118.95 114.93 1a75 s ARG 75 Ca 0.70 1.08 -0.18 0.00 -0.47 0.00 0.00 55.73 56.86 1a75 s ARG 75 Cb -0.25 -2.16 -0.05 0.00 -0.57 0.00 0.00 34.95 31.92 1a75 s ARG 75 CO 0.53 -0.15 1.08 0.00 -1.08 0.00 0.00 175.30 175.68 1a75 s ALA 76 N -2.31 2.73 0.41 7.88 0.00 -1.26 -4.54 121.76 124.66 1a75 s ALA 76 Ca 0.61 0.57 -0.25 0.00 0.00 0.00 0.00 51.96 52.89 1a75 s ALA 76 Cb -0.10 -3.28 -0.08 0.00 0.00 0.00 0.00 23.12 19.66 1a75 s ALA 76 CO 0.20 -0.72 1.23 -0.51 0.00 0.00 0.00 175.76 175.95 1a75 s LEU 77 N -4.10 4.17 0.87 0.00 1.43 0.33 -5.01 118.68 116.35 1a75 s LEU 77 Ca 0.67 2.49 -0.11 0.00 -1.03 0.00 0.00 54.13 56.15 1a75 s LEU 77 Cb -0.18 -4.00 0.11 0.00 0.03 0.00 0.00 46.19 42.14 1a75 s LEU 77 CO 0.30 -0.81 1.09 0.42 0.23 0.00 0.00 176.35 177.59 1a75 s THR 78 N -1.35 2.82 0.27 5.49 -4.23 -1.26 -4.74 115.64 112.64 1a75 s THR 78 Ca 0.58 0.26 -0.00 0.00 -1.18 0.00 0.00 61.69 61.35 1a75 s THR 78 Cb -0.34 -2.73 0.27 0.00 1.34 0.00 0.00 72.50 71.04 1a75 s THR 78 CO 0.43 -0.35 1.84 0.44 -0.54 0.00 0.00 174.62 176.44 1a75 h ASP 79 N -1.46 0.90 0.03 3.99 5.19 -1.99 -0.01 116.42 123.08 1a75 h ASP 79 Ca -0.48 0.04 -0.12 0.00 -0.62 0.00 0.00 57.03 55.85 1a75 h ASP 79 Cb 1.27 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 40.63 1a75 h ASP 79 CO 0.53 0.50 -0.39 0.00 -3.12 0.00 0.00 179.24 176.76 1a75 h ALA 80 N 1.51 0.94 0.06 3.45 0.00 -1.99 -0.14 119.26 123.09 1a75 h ALA 80 Ca 0.47 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1a75 h ALA 80 Cb 0.41 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1a75 h ALA 80 CO -0.25 0.62 -0.03 0.93 0.00 0.00 0.00 179.25 180.53 1a75 h GLU 81 N 0.39 -0.08 -0.95 0.00 5.08 -1.68 -2.05 114.58 115.29 1a75 h GLU 81 Ca 0.04 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.46 1a75 h GLU 81 Cb 0.86 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 30.06 1a75 h GLU 81 CO 0.07 0.13 0.61 1.15 -1.00 0.00 0.00 179.01 179.98 1a75 h THR 82 N -0.28 1.08 -0.60 1.13 2.02 -0.89 -1.27 112.91 114.10 1a75 h THR 82 Ca -0.01 -0.38 0.02 0.00 0.77 0.00 0.00 66.41 66.81 1a75 h THR 82 Cb 0.25 -0.13 -0.04 0.00 -1.74 0.00 0.00 68.15 66.49 1a75 h THR 82 CO 0.01 0.20 0.37 0.11 0.37 0.00 0.00 175.52 176.59 1a75 h LYS 83 N 1.12 0.72 -0.08 6.66 1.57 -0.86 -1.22 116.57 124.48 1a75 h LYS 83 Ca 0.41 -0.04 -0.20 0.00 -1.87 0.00 0.00 60.65 58.95 1a75 h LYS 83 Cb 0.15 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 1a75 h LYS 83 CO -0.17 0.48 -0.78 0.00 -0.57 0.00 0.00 179.45 178.41 1a75 h ALA 84 N 1.25 0.50 -0.12 3.86 0.00 -0.62 -2.01 119.26 122.12 1a75 h ALA 84 Ca 0.24 -0.62 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 1a75 h ALA 84 Cb -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1a75 h ALA 84 CO -0.09 0.76 -0.28 0.35 0.00 0.00 0.00 179.25 179.98 1a75 h PHE 85 N 0.32 0.52 -0.34 0.00 3.57 -1.21 -2.46 116.94 117.34 1a75 h PHE 85 Ca -0.04 -0.20 0.05 0.00 3.53 0.00 0.00 57.97 61.31 1a75 h PHE 85 Cb 1.38 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.98 1a75 h PHE 85 CO 0.06 0.90 0.07 1.25 -2.23 0.00 0.00 178.31 178.36 1a75 h LEU 86 N -0.01 0.02 -1.27 0.59 5.85 -1.20 -2.36 115.31 116.94 1a75 h LEU 86 Ca -0.00 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1a75 h LEU 86 Cb 0.88 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 1a75 h LEU 86 CO 0.06 0.05 0.51 0.50 -0.34 0.00 0.00 178.44 179.22 1a75 h LYS 87 N 0.19 0.93 -0.46 1.25 3.64 -1.30 0.11 116.57 120.93 1a75 h LYS 87 Ca 0.16 -0.06 -0.14 0.00 -1.27 0.00 0.00 60.65 59.35 1a75 h LYS 87 Cb 0.18 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1a75 h LYS 87 CO -0.21 0.61 -0.26 0.00 -2.27 0.00 0.00 179.45 177.33 1a75 h ALA 88 N 1.55 0.66 0.00 5.00 0.00 -1.03 -3.27 119.26 122.16 1a75 h ALA 88 Ca 0.31 -0.41 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 1a75 h ALA 88 Cb 0.04 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1a75 h ALA 88 CO -0.09 0.68 -1.23 0.78 0.00 0.00 0.00 179.25 179.39 1a75 h GLY 89 N 0.85 0.00 -7.52 0.00 0.00 -0.90 -3.43 103.07 92.08 1a75 h GLY 89 Ca 0.10 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.73 1a75 h GLY 89 CO 0.07 0.00 1.13 -0.35 0.00 0.00 0.00 176.54 177.39 1a75 s ASP 90 N -6.20 6.76 0.10 0.19 2.15 0.33 -4.79 116.67 115.20 1a75 s ASP 90 Ca -0.01 -2.28 -0.02 0.00 0.43 0.00 0.00 52.55 50.66 1a75 s ASP 90 Cb 0.09 -2.43 -0.23 0.00 -0.30 0.00 0.00 42.92 40.05 1a75 s ASP 90 CO 0.80 -1.02 1.20 0.77 -0.17 0.00 0.00 175.17 176.75 1a75 h SER 91 N 8.37 0.37 0.59 -0.34 4.64 -1.84 -3.24 113.55 122.10 1a75 h SER 91 Ca 0.22 -0.37 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1a75 h SER 91 Cb 0.97 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1a75 h SER 91 CO 1.20 1.26 -0.16 -0.90 -0.87 0.00 0.00 176.83 177.37 1a75 n ASP 92 N -3.55 0.32 -0.23 4.97 5.68 -1.26 -4.93 116.55 117.55 1a75 n ASP 92 Ca -0.07 -0.17 -0.03 0.00 -0.50 0.00 0.00 54.79 54.02 1a75 n ASP 92 Cb 0.97 -0.14 -0.01 0.00 -1.14 0.00 0.00 41.12 40.80 1a75 n ASP 92 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1a75 n GLY 93 N 1.39 0.51 0.21 6.12 0.00 -1.22 -4.91 105.19 107.29 1a75 n GLY 93 Ca 0.10 -0.92 0.15 0.00 0.00 0.00 0.00 46.02 45.35 1a75 n GLY 93 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1a75 n ASP 94 N 1.55 0.66 0.00 1.61 5.75 -1.26 -4.89 116.55 119.97 1a75 n ASP 94 Ca -0.03 -1.23 0.00 0.00 -0.01 0.00 0.00 54.79 53.52 1a75 n ASP 94 Cb 0.19 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 1a75 n ASP 94 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1a75 n GLY 95 N 1.07 0.45 3.13 6.12 0.00 -1.26 -5.04 105.19 109.66 1a75 n GLY 95 Ca 0.21 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.41 1a75 n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a75 s ALA 96 N -2.00 0.75 -0.31 4.61 0.00 -1.26 -4.43 121.76 119.12 1a75 s ALA 96 Ca 0.00 -1.37 -0.08 0.00 0.00 0.00 0.00 51.96 50.51 1a75 s ALA 96 Cb 0.00 0.61 0.00 0.00 0.00 0.00 0.00 23.12 23.74 1a75 s ALA 96 CO 0.00 -0.43 0.11 0.42 0.00 0.00 0.00 175.76 175.86 1a75 s ILE 97 N -3.98 4.24 0.55 0.00 -1.09 -0.27 -4.58 121.20 116.07 1a75 s ILE 97 Ca 0.17 -0.60 -0.03 0.00 -2.23 0.00 0.00 60.65 57.96 1a75 s ILE 97 Cb 0.08 -3.19 0.02 0.00 -1.58 0.00 0.00 42.46 37.79 1a75 s ILE 97 CO -0.03 0.06 0.82 -0.83 -1.23 0.00 0.00 174.94 173.73 1a75 s GLY 98 N 1.54 1.65 0.44 6.18 0.00 -1.26 -1.00 107.32 114.86 1a75 s GLY 98 Ca 0.03 -0.96 0.14 0.00 0.00 0.00 0.00 44.72 43.93 1a75 s GLY 98 CO 0.04 -0.70 1.98 -0.24 0.00 0.00 0.00 173.10 174.19 1a75 h VAL 99 N -0.01 0.90 -0.13 1.40 3.04 -1.99 0.59 116.25 120.06 1a75 h VAL 99 Ca -0.45 -0.14 -0.19 0.00 -1.01 0.00 0.00 66.70 64.91 1a75 h VAL 99 Cb 1.27 0.46 -0.00 0.00 -2.01 0.00 0.00 31.29 31.01 1a75 h VAL 99 CO 0.58 0.07 -0.70 -0.33 -1.01 0.00 0.00 177.57 176.18 1a75 h GLU 100 N 0.41 0.57 -0.23 4.17 3.07 -1.98 -1.59 114.58 119.00 1a75 h GLU 100 Ca 0.27 -0.44 -0.18 0.00 -0.50 0.00 0.00 59.36 58.51 1a75 h GLU 100 Cb 0.52 0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.51 1a75 h GLU 100 CO -0.07 1.06 -0.58 0.93 -1.40 0.00 0.00 179.01 178.95 1a75 h GLU 101 N 0.40 0.74 0.31 2.33 5.08 -1.19 -2.02 114.58 120.23 1a75 h GLU 101 Ca -0.03 -0.48 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1a75 h GLU 101 Cb 1.29 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.57 1a75 h GLU 101 CO 0.13 1.11 -0.49 2.35 -1.00 0.00 0.00 179.01 181.11 1a75 h TRP 102 N 0.56 -1.38 -0.62 4.33 2.91 0.08 -1.31 115.95 120.51 1a75 h TRP 102 Ca 0.00 0.02 0.10 0.00 1.13 0.00 0.00 58.89 60.15 1a75 h TRP 102 Cb 1.17 0.56 -0.04 0.00 -0.51 0.00 0.00 29.16 30.34 1a75 h TRP 102 CO 0.06 -0.62 0.42 0.28 -1.03 0.00 0.00 178.44 177.55 1a75 h VAL 103 N -0.86 0.89 -0.39 2.65 2.07 -1.14 0.11 116.25 119.59 1a75 h VAL 103 Ca -0.03 -0.15 -0.13 0.00 0.82 0.00 0.00 66.70 67.21 1a75 h VAL 103 Cb 0.80 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1a75 h VAL 103 CO -0.16 0.08 -0.27 0.00 0.02 0.00 0.00 177.57 177.23 1a75 h ALA 104 N 1.69 0.56 -0.13 1.67 0.00 -1.11 -3.31 119.26 118.62 1a75 h ALA 104 Ca 0.29 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1a75 h ALA 104 Cb 0.56 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1a75 h ALA 104 CO -0.08 0.57 -0.49 1.25 0.00 0.00 0.00 179.25 180.50 1a75 h LEU 105 N 0.68 0.37 -1.69 0.00 6.46 0.18 -2.78 115.31 118.53 1a75 h LEU 105 Ca 0.08 -0.18 -0.04 0.00 -0.12 0.00 0.00 57.88 57.62 1a75 h LEU 105 Cb 0.85 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 1a75 h LEU 105 CO 0.07 0.80 -0.18 0.58 -0.62 0.00 0.00 178.44 179.09 1a75 h VAL 106 N 0.27 0.80 -4.16 1.05 2.07 -1.43 -3.46 116.25 111.38 1a75 h VAL 106 Ca 0.01 -0.73 -0.51 0.00 0.82 0.00 0.00 66.70 66.30 1a75 h VAL 106 Cb 0.96 1.43 0.10 0.00 -1.52 0.00 0.00 31.29 32.26 1a75 h VAL 106 CO 0.08 0.18 0.40 -0.54 0.02 0.00 0.00 177.57 177.71 1a75 s LYS 107 N -4.24 2.95 0.00 1.57 1.02 -1.05 -4.37 119.74 115.62 1a75 s LYS 107 Ca -0.03 1.50 0.06 0.00 0.02 0.00 0.00 55.97 57.52 1a75 s LYS 107 Cb 0.14 -1.96 0.37 0.00 -0.52 0.00 0.00 37.83 35.86 1a75 s LYS 107 CO 0.63 -1.15 0.84 0.00 -0.92 0.00 0.00 175.35 174.75