#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dnu n PRO 2 N 0.00 2.42 -0.24 0.00 -0.02 -1.26 -4.89 135.00 131.01 1dnu n PRO 2 Ca 0.00 0.85 0.07 0.00 -2.02 0.00 0.00 63.50 62.40 1dnu n PRO 2 Cb 0.00 -2.60 0.32 0.00 -0.02 0.00 0.00 33.50 31.20 1dnu n PRO 2 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1dnu h GLU 3 N 2.63 0.81 -4.15 -0.52 4.81 -2.06 -3.42 114.58 112.68 1dnu h GLU 3 Ca -0.50 -0.05 -0.21 0.00 -0.13 0.00 0.00 59.36 58.47 1dnu h GLU 3 Cb 1.26 -0.18 -0.22 0.00 0.63 0.00 0.00 28.75 30.24 1dnu h GLU 3 CO 0.62 0.53 -0.71 -1.14 -0.73 0.00 0.00 179.01 177.59 1dnu s GLN 4 N -5.75 0.36 0.34 1.92 0.74 -1.26 -5.16 119.66 110.84 1dnu s GLN 4 Ca -0.10 -0.59 0.04 0.00 0.05 0.00 0.00 55.36 54.75 1dnu s GLN 4 Cb 0.20 -0.04 -0.01 0.00 1.10 0.00 0.00 33.01 34.26 1dnu s GLN 4 CO 0.78 -0.01 0.38 -0.40 -0.55 0.00 0.00 175.29 175.49 1dnu n ASP 5 N 1.72 -1.01 0.00 6.67 3.85 -1.26 -5.09 116.55 121.43 1dnu n ASP 5 Ca -0.22 -3.08 0.00 0.00 -0.71 0.00 0.00 54.79 50.78 1dnu n ASP 5 Cb 0.55 2.08 0.00 0.00 -1.35 0.00 0.00 41.12 42.40 1dnu n ASP 5 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1dnu n LYS 6 N -0.61 2.67 -4.21 0.11 5.02 -1.26 -5.11 118.16 114.77 1dnu n LYS 6 Ca 0.05 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.20 1dnu n LYS 6 Cb 0.60 -0.87 -0.09 0.00 -0.02 0.00 0.00 35.03 34.65 1dnu n LYS 6 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1dnu s TYR 7 N -1.69 1.28 0.48 2.13 2.02 -1.26 -5.14 117.35 115.17 1dnu s TYR 7 Ca 0.00 -1.42 -0.23 0.00 -0.37 0.00 0.00 57.07 55.05 1dnu s TYR 7 Cb 0.00 -0.54 -0.07 0.00 -0.40 0.00 0.00 41.96 40.95 1dnu s TYR 7 CO 0.00 -0.75 1.24 1.03 -1.57 0.00 0.00 175.55 175.50 1dnu s ARG 8 N -3.89 3.60 0.78 -0.62 0.52 -1.26 -5.02 118.95 113.05 1dnu s ARG 8 Ca 0.38 1.97 -0.11 0.00 -0.52 0.00 0.00 55.73 57.45 1dnu s ARG 8 Cb 0.05 -2.41 0.06 0.00 0.52 0.00 0.00 34.95 33.16 1dnu s ARG 8 CO 0.17 -0.74 1.09 0.95 0.02 0.00 0.00 175.30 176.79 1dnu s THR 9 N -1.43 3.18 0.15 0.02 -4.23 -1.26 -4.98 115.64 107.09 1dnu s THR 9 Ca 0.65 0.38 -0.08 0.00 -1.18 0.00 0.00 61.69 61.46 1dnu s THR 9 Cb -0.34 -3.16 -0.08 0.00 1.34 0.00 0.00 72.50 70.26 1dnu s THR 9 CO 0.41 -0.50 1.43 0.40 -0.54 0.00 0.00 174.62 175.82 1dnu h ILE 10 N -1.01 1.29 0.00 2.99 1.08 -1.95 -3.24 117.51 116.67 1dnu h ILE 10 Ca -0.47 -1.79 0.00 0.00 -0.39 0.00 0.00 64.86 62.21 1dnu h ILE 10 Cb 1.26 1.72 0.00 0.00 -3.07 0.00 0.00 36.82 36.74 1dnu h ILE 10 CO 0.60 0.57 -0.03 0.71 -0.69 0.00 0.00 178.15 179.31 1dnu h THR 11 N 0.57 0.00 0.00 -0.27 1.35 -1.99 -3.47 112.91 109.10 1dnu h THR 11 Ca 0.00 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1dnu h THR 11 Cb 1.17 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.09 1dnu h THR 11 CO 0.12 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.00 1dnu n GLY 12 N 1.29 1.12 3.68 5.82 0.00 -1.23 -0.78 105.19 115.09 1dnu n GLY 12 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1dnu n GLY 12 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1dnu n MET 13 N -2.00 1.72 -0.88 1.61 0.00 -1.26 -2.79 117.12 113.52 1dnu n MET 13 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 57.70 58.32 1dnu n MET 13 Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 33.22 30.93 1dnu n MET 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1dnu h ASN 15 N 0.00 -0.15 -3.58 0.00 -0.73 -1.74 -3.35 115.58 106.03 1dnu h ASN 15 Ca 0.00 0.04 -0.69 0.00 1.87 0.00 0.00 56.30 57.52 1dnu h ASN 15 Cb 0.02 0.09 -0.19 0.00 0.27 0.00 0.00 38.32 38.52 1dnu h ASN 15 CO 0.00 -0.06 -0.27 0.21 -0.37 0.00 0.00 177.43 176.93 1dnu s ASN 16 N -5.17 6.17 0.23 1.15 3.84 -1.26 -4.97 114.94 114.93 1dnu s ASN 16 Ca -0.13 -0.56 0.06 0.00 0.21 0.00 0.00 52.86 52.43 1dnu s ASN 16 Cb 0.09 -2.20 0.22 0.00 -0.55 0.00 0.00 41.25 38.81 1dnu s ASN 16 CO 0.67 -0.48 1.54 0.03 -2.79 0.00 0.00 177.10 176.07 1dnu h ARG 17 N 8.63 0.15 -0.07 0.43 3.08 -1.94 -0.55 114.38 124.09 1dnu h ARG 17 Ca -0.28 -0.11 -0.14 0.00 0.07 0.00 0.00 59.98 59.52 1dnu h ARG 17 Cb 1.12 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 1dnu h ARG 17 CO 0.75 0.76 -0.58 0.00 -1.07 0.00 0.00 179.97 179.83 1dnu h ARG 18 N 0.10 0.22 -2.31 0.04 3.08 -1.95 -3.35 114.38 110.21 1dnu h ARG 18 Ca -0.01 -0.14 -0.58 0.00 0.07 0.00 0.00 59.98 59.31 1dnu h ARG 18 Cb 1.19 0.02 -0.39 0.00 0.08 0.00 0.00 29.97 30.87 1dnu h ARG 18 CO 0.10 0.74 -0.96 0.45 -1.07 0.00 0.00 179.97 179.23 1dnu n SER 19 N -3.88 0.31 0.23 7.04 2.88 -1.18 -5.03 113.62 113.99 1dnu n SER 19 Ca -0.02 -2.62 0.10 0.00 -1.33 0.00 0.00 58.87 55.01 1dnu n SER 19 Cb 0.60 -0.61 0.56 0.00 -0.75 0.00 0.00 64.21 64.01 1dnu n SER 19 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1dnu h PRO 20 N 5.01 0.00 -0.01 -1.46 0.13 -1.24 -1.93 132.00 132.50 1dnu h PRO 20 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1dnu h PRO 20 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1dnu h PRO 20 CO 0.46 0.00 -0.25 0.25 -0.23 0.00 0.00 178.00 178.23 1dnu n THR 21 N -2.39 0.00 -1.90 1.56 -2.24 -1.26 -0.84 114.28 107.21 1dnu n THR 21 Ca -0.01 -0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.25 1dnu n THR 21 Cb 0.31 0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.76 1dnu n THR 21 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1dnu s LEU 22 N -2.58 4.11 0.00 3.22 1.43 -0.73 -0.94 118.68 123.20 1dnu s LEU 22 Ca 0.23 2.13 0.00 0.00 -1.03 0.00 0.00 54.13 55.46 1dnu s LEU 22 Cb 0.19 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.88 1dnu s LEU 22 CO 0.53 -1.20 0.00 0.61 0.23 0.00 0.00 176.35 176.53 1dnu n GLY 23 N 4.61 1.24 3.84 -3.19 0.00 -1.26 -4.58 105.19 105.85 1dnu n GLY 23 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1dnu n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dnu s ALA 24 N -3.09 3.03 0.68 4.61 0.00 -0.12 -4.76 121.76 122.12 1dnu s ALA 24 Ca 0.00 0.22 -0.15 0.00 0.00 0.00 0.00 51.96 52.03 1dnu s ALA 24 Cb 0.00 -3.13 0.01 0.00 0.00 0.00 0.00 23.12 20.00 1dnu s ALA 24 CO 0.00 -0.29 1.15 -1.54 0.00 0.00 0.00 175.76 175.08 1dnu s SER 25 N -3.00 4.78 -1.23 0.00 1.04 0.04 -4.14 113.70 111.19 1dnu s SER 25 Ca 0.60 2.13 -0.01 0.00 0.48 0.00 0.00 55.95 59.15 1dnu s SER 25 Cb -0.11 -2.57 -0.00 0.00 0.10 0.00 0.00 66.02 63.44 1dnu s SER 25 CO 0.31 -1.86 0.89 0.59 0.98 0.00 0.00 173.24 174.15 1dnu n ASN 26 N -2.50 -2.08 -4.14 7.02 3.02 -1.26 -5.03 115.26 110.28 1dnu n ASN 26 Ca 0.11 -0.70 -0.14 0.00 -0.03 0.00 0.00 54.58 53.82 1dnu n ASN 26 Cb 0.51 -4.73 -0.11 0.00 -0.61 0.00 0.00 39.78 34.84 1dnu n ASN 26 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1dnu s ARG 27 N -5.52 0.76 0.45 3.52 1.81 -1.26 -5.13 118.95 113.57 1dnu s ARG 27 Ca 0.04 -1.05 -0.24 0.00 -1.72 0.00 0.00 55.73 52.76 1dnu s ARG 27 Cb -0.01 -0.46 -0.08 0.00 -0.45 0.00 0.00 34.95 33.95 1dnu s ARG 27 CO 0.76 0.07 1.31 0.00 -0.68 0.00 0.00 175.30 176.77 1dnu s ALA 28 N -2.16 3.12 0.69 2.13 0.00 -1.26 -4.97 121.76 119.31 1dnu s ALA 28 Ca 0.01 1.25 -0.16 0.00 0.00 0.00 0.00 51.96 53.06 1dnu s ALA 28 Cb -0.05 -3.50 0.02 0.00 0.00 0.00 0.00 23.12 19.59 1dnu s ALA 28 CO -0.00 -0.98 1.24 -0.06 0.00 0.00 0.00 175.76 175.96 1dnu s PHE 29 N -1.30 2.07 0.44 0.00 0.40 -1.26 -5.01 117.98 113.32 1dnu s PHE 29 Ca 0.62 1.56 -0.20 0.00 -0.60 0.00 0.00 56.93 58.30 1dnu s PHE 29 Cb -0.38 -3.55 -0.11 0.00 0.51 0.00 0.00 43.02 39.49 1dnu s PHE 29 CO 0.48 -2.71 0.96 0.54 0.70 0.00 0.00 175.22 175.19 1dnu s VAL 30 N -1.75 4.40 -0.13 -0.44 0.11 -1.26 -5.07 120.40 116.26 1dnu s VAL 30 Ca 0.77 1.45 -0.02 0.00 -2.93 0.00 0.00 61.98 61.26 1dnu s VAL 30 Cb -0.32 -3.61 -0.02 0.00 -1.53 0.00 0.00 36.38 30.89 1dnu s VAL 30 CO 0.42 -0.37 -0.08 -0.13 -3.33 0.00 0.00 175.10 171.62 1dnu s ARG 31 N -3.30 3.42 0.07 1.54 0.52 -1.26 -5.00 118.95 114.94 1dnu s ARG 31 Ca 0.62 -0.58 0.25 0.00 -0.52 0.00 0.00 55.73 55.50 1dnu s ARG 31 Cb -0.09 -2.76 0.59 0.00 0.52 0.00 0.00 34.95 33.21 1dnu s ARG 31 CO 0.15 0.30 1.50 0.91 0.02 0.00 0.00 175.30 178.19 1dnu n TRP 32 N 3.31 0.32 -3.98 -0.53 8.01 -1.26 -4.90 117.44 118.42 1dnu n TRP 32 Ca -0.18 0.09 -0.08 0.00 -1.31 0.00 0.00 57.50 56.03 1dnu n TRP 32 Cb 0.53 -0.53 -0.09 0.00 -2.01 0.00 0.00 31.31 29.21 1dnu n TRP 32 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 1dnu s LEU 33 N -3.65 1.99 0.41 -0.99 1.43 -1.26 -5.14 118.68 111.47 1dnu s LEU 33 Ca 0.10 -0.81 -0.27 0.00 -1.03 0.00 0.00 54.13 52.12 1dnu s LEU 33 Cb 0.16 0.58 -0.09 0.00 0.03 0.00 0.00 46.19 46.86 1dnu s LEU 33 CO 0.67 -0.64 1.43 -2.84 0.23 0.00 0.00 176.35 175.20 1dnu s PRO 34 N -3.76 3.92 0.63 1.29 0.02 -1.26 -4.97 135.00 130.87 1dnu s PRO 34 Ca 0.05 2.44 -0.17 0.00 0.02 0.00 0.00 61.00 63.35 1dnu s PRO 34 Cb 0.06 -2.81 -0.02 0.00 0.02 0.00 0.00 34.50 31.75 1dnu s PRO 34 CO -0.10 -0.64 1.14 0.00 -0.33 0.00 0.00 177.00 177.07 1dnu s ALA 35 N -1.17 2.49 -0.29 -1.55 0.00 -1.26 -5.03 121.76 114.95 1dnu s ALA 35 Ca 0.57 0.73 0.02 0.00 0.00 0.00 0.00 51.96 53.27 1dnu s ALA 35 Cb -0.44 -3.37 0.08 0.00 0.00 0.00 0.00 23.12 19.40 1dnu s ALA 35 CO 0.58 -1.20 0.02 -1.21 0.00 0.00 0.00 175.76 173.95 1dnu s GLU 36 N -3.74 1.35 0.21 0.00 2.02 -1.26 -4.99 118.70 112.29 1dnu s GLU 36 Ca 0.71 -1.34 0.11 0.00 0.02 0.00 0.00 54.97 54.47 1dnu s GLU 36 Cb -0.24 -2.66 -0.05 0.00 0.10 0.00 0.00 34.13 31.29 1dnu s GLU 36 CO 0.37 -0.82 -0.22 0.71 0.02 0.00 0.00 175.26 175.32 1dnu s TYR 37 N 1.27 2.22 0.24 1.61 2.02 -1.26 -4.77 117.35 118.67 1dnu s TYR 37 Ca 0.04 -0.37 -0.06 0.00 -0.37 0.00 0.00 57.07 56.32 1dnu s TYR 37 Cb -0.19 -1.06 0.42 0.00 -0.40 0.00 0.00 41.96 40.74 1dnu s TYR 37 CO -0.12 0.54 1.72 1.49 -1.57 0.00 0.00 175.55 177.61 1dnu h GLU 38 N 2.92 0.38 -0.48 -0.62 4.81 -0.38 -0.97 114.58 120.25 1dnu h GLU 38 Ca -0.44 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1dnu h GLU 38 Cb 1.22 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1dnu h GLU 38 CO 0.52 0.25 0.00 -0.40 -0.73 0.00 0.00 179.01 178.65 1dnu n ASP 39 N -5.04 3.61 0.00 1.04 3.85 -1.26 -4.96 116.55 113.79 1dnu n ASP 39 Ca 0.13 -1.99 0.00 0.00 -0.71 0.00 0.00 54.79 52.22 1dnu n ASP 39 Cb 0.39 -0.31 0.00 0.00 -1.35 0.00 0.00 41.12 39.85 1dnu n ASP 39 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1dnu n GLY 40 N 1.54 3.06 0.00 6.12 0.00 -0.37 -4.76 105.19 110.78 1dnu n GLY 40 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1dnu n GLY 40 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1dnu n PHE 41 N -0.79 0.00 0.00 1.61 -1.74 -1.26 -4.52 117.46 110.75 1dnu n PHE 41 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 1dnu n PHE 41 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 1dnu n PHE 41 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 1dnu n SER 42 N -0.28 0.00 -4.72 5.98 2.88 -1.26 -5.03 113.62 111.19 1dnu n SER 42 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 1dnu n SER 42 Cb 0.00 0.17 -0.04 0.00 -0.75 0.00 0.00 64.21 63.59 1dnu n SER 42 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1dnu s LEU 43 N -4.29 4.45 0.50 2.46 1.43 -1.26 -4.94 118.68 117.03 1dnu s LEU 43 Ca 0.00 1.80 -0.20 0.00 -1.03 0.00 0.00 54.13 54.69 1dnu s LEU 43 Cb 0.00 -3.58 -0.07 0.00 0.03 0.00 0.00 46.19 42.56 1dnu s LEU 43 CO 0.00 -0.16 1.08 -2.16 0.23 0.00 0.00 176.35 175.34 1dnu s PRO 44 N 0.31 3.66 0.32 1.29 0.04 -1.26 0.30 135.00 139.66 1dnu s PRO 44 Ca 0.49 1.51 -0.29 0.00 0.04 0.00 0.00 61.00 62.75 1dnu s PRO 44 Cb -0.24 -2.12 -0.11 0.00 0.04 0.00 0.00 34.50 32.07 1dnu s PRO 44 CO 0.30 -0.58 1.52 0.71 0.04 0.00 0.00 177.00 178.99 1dnu s TYR 45 N -1.84 2.75 0.00 0.56 1.51 -1.26 -1.54 117.35 117.53 1dnu s TYR 45 Ca 0.68 0.98 0.00 0.00 -1.01 0.00 0.00 57.07 57.72 1dnu s TYR 45 Cb -0.21 -4.00 0.00 0.00 -0.11 0.00 0.00 41.96 37.64 1dnu s TYR 45 CO 0.24 -3.17 0.00 0.41 -1.11 0.00 0.00 175.55 171.92 1dnu n GLY 46 N 1.52 0.18 0.08 0.71 0.00 -1.26 -4.97 105.19 101.44 1dnu n GLY 46 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1dnu n GLY 46 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1dnu h TRP 47 N 0.00 -0.07 -3.62 1.61 2.91 -1.66 -3.43 115.95 111.69 1dnu h TRP 47 Ca 0.00 -0.00 -0.63 0.00 1.13 0.00 0.00 58.89 59.39 1dnu h TRP 47 Cb 0.00 0.02 -0.16 0.00 -0.51 0.00 0.00 29.16 28.52 1dnu h TRP 47 CO 0.00 0.26 -0.52 0.99 -1.03 0.00 0.00 178.44 178.14 1dnu s THR 48 N -4.84 5.20 -0.07 2.65 2.01 -1.26 -5.04 115.64 114.28 1dnu s THR 48 Ca -0.15 0.13 -0.38 0.00 0.31 0.00 0.00 61.69 61.60 1dnu s THR 48 Cb 0.03 -3.43 -0.15 0.00 0.01 0.00 0.00 72.50 68.96 1dnu s THR 48 CO 0.65 0.34 1.59 -2.65 -0.69 0.00 0.00 174.62 173.85 1dnu n PRO 49 N 4.41 1.36 0.00 4.92 -0.02 -1.26 -1.95 135.00 142.47 1dnu n PRO 49 Ca -0.15 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 1dnu n PRO 49 Cb 0.52 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1dnu n PRO 49 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dnu n GLY 50 N 3.49 2.12 3.64 -1.23 0.00 -1.26 -5.01 105.19 106.94 1dnu n GLY 50 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 1dnu n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dnu s VAL 51 N -2.56 4.51 0.65 1.61 1.01 -0.82 -5.02 120.40 119.79 1dnu s VAL 51 Ca 0.00 1.72 -0.10 0.00 0.00 0.00 0.00 61.98 63.60 1dnu s VAL 51 Cb 0.00 -4.42 -0.00 0.00 0.00 0.00 0.00 36.38 31.96 1dnu s VAL 51 CO 0.00 -0.48 1.04 -0.54 0.00 0.00 0.00 175.10 175.11 1dnu s LYS 52 N 3.65 3.12 -0.23 2.72 1.02 -1.26 -4.54 119.74 124.23 1dnu s LYS 52 Ca 0.45 0.47 -0.03 0.00 0.02 0.00 0.00 55.97 56.88 1dnu s LYS 52 Cb -0.12 -2.09 0.00 0.00 -0.52 0.00 0.00 37.83 35.10 1dnu s LYS 52 CO 0.15 -0.81 -0.05 0.50 -0.92 0.00 0.00 175.35 174.22 1dnu s ARG 53 N -5.23 3.23 -1.64 1.68 3.52 0.15 -4.73 118.95 115.94 1dnu s ARG 53 Ca 0.56 -0.72 -0.16 0.00 -0.13 0.00 0.00 55.73 55.28 1dnu s ARG 53 Cb -0.11 -2.99 0.13 0.00 -1.56 0.00 0.00 34.95 30.42 1dnu s ARG 53 CO 0.51 -0.25 0.83 -1.71 -0.81 0.00 0.00 175.30 173.88 1dnu n ASN 54 N 4.76 -3.63 0.00 -2.12 4.05 -1.26 -1.59 115.26 115.48 1dnu n ASN 54 Ca -0.18 -0.94 0.00 0.00 0.45 0.00 0.00 54.58 53.91 1dnu n ASN 54 Cb 0.50 -3.12 0.00 0.00 1.23 0.00 0.00 39.78 38.39 1dnu n ASN 54 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1dnu n GLY 55 N -1.51 0.72 3.10 8.20 0.00 -1.26 -5.06 105.19 109.37 1dnu n GLY 55 Ca 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 1dnu n GLY 55 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1dnu s PHE 56 N -2.53 0.80 0.49 1.61 0.08 -0.62 -5.07 117.98 112.74 1dnu s PHE 56 Ca 0.00 -0.55 -0.24 0.00 0.12 0.00 0.00 56.93 56.27 1dnu s PHE 56 Cb 0.00 -0.47 -0.07 0.00 -0.57 0.00 0.00 43.02 41.91 1dnu s PHE 56 CO 0.00 -0.06 1.36 -2.14 -0.10 0.00 0.00 175.22 174.27 1dnu s PRO 57 N -1.92 3.48 -0.05 0.24 0.02 -1.26 -0.67 135.00 134.84 1dnu s PRO 57 Ca -0.05 2.24 -0.30 0.00 0.02 0.00 0.00 61.00 62.91 1dnu s PRO 57 Cb -0.08 -2.46 -0.03 0.00 0.02 0.00 0.00 34.50 31.95 1dnu s PRO 57 CO 0.00 -0.92 1.08 0.08 -0.33 0.00 0.00 177.00 176.91 1dnu s VAL 58 N -1.29 4.56 0.08 3.83 1.01 -1.26 -4.78 120.40 122.55 1dnu s VAL 58 Ca 0.65 1.85 -0.30 0.00 0.00 0.00 0.00 61.98 64.18 1dnu s VAL 58 Cb -0.40 -4.19 -0.05 0.00 0.00 0.00 0.00 36.38 31.74 1dnu s VAL 58 CO 0.49 0.05 1.00 0.00 0.00 0.00 0.00 175.10 176.65 1dnu s ALA 59 N 1.72 3.24 0.14 5.51 0.00 -1.26 -4.98 121.76 126.13 1dnu s ALA 59 Ca 0.53 0.62 -0.34 0.00 0.00 0.00 0.00 51.96 52.76 1dnu s ALA 59 Cb -0.22 -3.32 -0.14 0.00 0.00 0.00 0.00 23.12 19.44 1dnu s ALA 59 CO 0.23 -0.15 1.56 1.28 0.00 0.00 0.00 175.76 178.68 1dnu n LEU 60 N 3.19 2.93 -0.35 0.00 4.32 -1.26 -4.87 117.00 120.96 1dnu n LEU 60 Ca 0.04 1.08 0.07 0.00 -0.02 0.00 0.00 56.01 57.18 1dnu n LEU 60 Cb 0.49 -1.39 0.24 0.00 -1.62 0.00 0.00 43.42 41.14 1dnu n LEU 60 CO 0.52 -0.37 1.24 0.00 -1.22 0.00 0.00 177.39 177.56 1dnu h ALA 61 N 5.92 1.53 -0.21 -1.18 0.00 -2.00 -1.16 119.26 122.16 1dnu h ALA 61 Ca -0.45 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 1dnu h ALA 61 Cb 1.26 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1dnu h ALA 61 CO 0.88 0.24 -0.22 -0.09 0.00 0.00 0.00 179.25 180.06 1dnu h ARG 62 N 1.00 0.37 -0.38 0.00 9.65 -1.99 -1.60 114.38 121.44 1dnu h ARG 62 Ca 0.48 -0.12 -0.11 0.00 -1.10 0.00 0.00 59.98 59.12 1dnu h ARG 62 Cb 0.44 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 1dnu h ARG 62 CO -0.24 0.58 -0.19 0.00 2.80 0.00 0.00 179.97 182.92 1dnu h ALA 63 N 1.43 0.53 -0.55 2.80 0.00 -1.62 0.29 119.26 122.14 1dnu h ALA 63 Ca 0.06 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1dnu h ALA 63 Cb 0.58 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1dnu h ALA 63 CO 0.04 0.48 0.18 0.28 0.00 0.00 0.00 179.25 180.23 1dnu h VAL 64 N 0.59 1.23 -0.29 0.00 2.07 -1.07 -0.39 116.25 118.39 1dnu h VAL 64 Ca 0.08 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 1dnu h VAL 64 Cb 0.74 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1dnu h VAL 64 CO 0.06 0.29 0.17 -1.28 0.02 0.00 0.00 177.57 176.83 1dnu h SER 65 N 0.76 0.35 -0.70 0.57 0.87 -1.19 0.29 113.55 114.51 1dnu h SER 65 Ca 0.18 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1dnu h SER 65 Cb 0.26 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.10 1dnu h SER 65 CO -0.01 0.30 0.44 0.78 -0.53 0.00 0.00 176.83 177.81 1dnu h ASN 66 N 0.36 0.82 0.86 6.23 2.35 -0.67 -0.71 115.58 124.82 1dnu h ASN 66 Ca 0.10 -0.04 -0.17 0.00 -0.55 0.00 0.00 56.30 55.64 1dnu h ASN 66 Cb 0.02 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.16 1dnu h ASN 66 CO -0.02 0.62 -1.24 -0.33 -1.65 0.00 0.00 177.43 174.81 1dnu h GLU 67 N 0.95 0.00 0.00 0.81 4.39 -0.89 -3.37 114.58 116.46 1dnu h GLU 67 Ca 0.25 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.88 1dnu h GLU 67 Cb -0.07 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 1dnu h GLU 67 CO -0.05 0.41 -1.28 -0.89 -1.16 0.00 0.00 179.01 176.03 1dnu n ILE 68 N -3.01 0.28 -0.03 3.13 5.41 0.08 -4.83 119.36 120.39 1dnu n ILE 68 Ca -0.07 -0.14 -0.21 0.00 1.00 0.00 0.00 62.75 63.33 1dnu n ILE 68 Cb 0.85 -0.78 -0.13 0.00 -0.71 0.00 0.00 39.64 38.87 1dnu n ILE 68 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1dnu h VAL 69 N 0.00 0.99 -1.91 1.39 2.07 -1.29 -3.47 116.25 114.02 1dnu h VAL 69 Ca -0.11 -2.32 -0.65 0.00 0.82 0.00 0.00 66.70 64.43 1dnu h VAL 69 Cb 1.21 2.59 0.07 0.00 -1.52 0.00 0.00 31.29 33.63 1dnu h VAL 69 CO -0.01 0.62 0.39 -1.14 0.02 0.00 0.00 177.57 177.44 1dnu n ARG 70 N -4.05 1.26 -3.70 1.57 0.63 -0.39 -5.01 116.66 106.99 1dnu n ARG 70 Ca -0.27 0.45 -0.14 0.00 -0.92 0.00 0.00 57.85 56.98 1dnu n ARG 70 Cb 0.83 -2.03 -0.07 0.00 0.45 0.00 0.00 32.46 31.64 1dnu n ARG 70 CO 0.00 0.00 0.00 -0.59 -2.51 0.00 0.00 177.63 174.53 1dnu s PHE 71 N 0.12 -0.27 -0.01 -0.14 -0.71 -1.26 -4.97 117.98 110.74 1dnu s PHE 71 Ca 0.77 0.37 -0.30 0.00 -1.04 0.00 0.00 56.93 56.73 1dnu s PHE 71 Cb -0.87 0.18 -0.06 0.00 -1.21 0.00 0.00 43.02 41.06 1dnu s PHE 71 CO 0.49 -0.48 1.62 -2.14 -1.34 0.00 0.00 175.22 173.37 1dnu s PRO 72 N -1.71 4.20 0.63 1.99 0.02 -1.26 -4.89 135.00 133.98 1dnu s PRO 72 Ca -0.10 2.20 0.34 0.00 0.02 0.00 0.00 61.00 63.46 1dnu s PRO 72 Cb -0.03 -3.80 1.89 0.00 0.02 0.00 0.00 34.50 32.58 1dnu s PRO 72 CO 0.03 -0.77 2.15 1.15 -0.33 0.00 0.00 177.00 179.22 1dnu h THR 73 N 5.23 0.22 0.00 0.99 2.02 -2.01 -0.87 112.91 118.49 1dnu h THR 73 Ca -0.40 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.78 1dnu h THR 73 Cb 1.19 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 1dnu h THR 73 CO 0.94 0.00 0.00 -0.90 0.37 0.00 0.00 175.52 175.93 1dnu n ASP 74 N -3.37 0.32 -0.07 4.18 5.75 -1.26 -1.88 116.55 120.22 1dnu n ASP 74 Ca -0.01 0.59 0.12 0.00 -0.01 0.00 0.00 54.79 55.48 1dnu n ASP 74 Cb 0.25 -0.65 0.32 0.00 -1.03 0.00 0.00 41.12 40.01 1dnu n ASP 74 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1dnu n GLN 75 N -1.86 0.27 -1.59 0.11 1.13 -0.33 -4.97 117.38 110.13 1dnu n GLN 75 Ca 0.02 -0.15 -0.51 0.00 -1.94 0.00 0.00 57.00 54.43 1dnu n GLN 75 Cb 0.18 -1.50 -0.05 0.00 0.11 0.00 0.00 30.24 28.98 1dnu n GLN 75 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1dnu n LEU 76 N -1.24 1.66 -4.41 1.08 0.00 -0.79 -4.94 117.00 108.38 1dnu n LEU 76 Ca 0.08 1.13 -0.40 0.00 0.00 0.00 0.00 56.01 56.82 1dnu n LEU 76 Cb 0.34 -1.21 -0.11 0.00 0.00 0.00 0.00 43.42 42.43 1dnu n LEU 76 CO 0.32 -1.11 -0.18 -0.89 0.00 0.00 0.00 177.39 175.53 1dnu s THR 77 N 0.24 4.60 0.14 1.96 2.01 -1.26 -5.07 115.64 118.26 1dnu s THR 77 Ca 0.80 -0.67 -0.31 0.00 0.31 0.00 0.00 61.69 61.83 1dnu s THR 77 Cb -0.90 -3.47 -0.08 0.00 0.01 0.00 0.00 72.50 68.06 1dnu s THR 77 CO 0.48 -0.11 1.32 -2.84 -0.69 0.00 0.00 174.62 172.79 1dnu s PRO 78 N 1.58 4.37 -0.37 4.92 0.02 -1.26 -4.95 135.00 139.31 1dnu s PRO 78 Ca 0.03 2.01 -0.29 0.00 0.02 0.00 0.00 61.00 62.77 1dnu s PRO 78 Cb -0.18 -3.25 0.00 0.00 0.02 0.00 0.00 34.50 31.09 1dnu s PRO 78 CO 0.07 -0.33 1.45 0.34 -0.33 0.00 0.00 177.00 178.20 1dnu s ASP 79 N 0.79 6.34 0.25 2.53 3.68 -1.26 -4.87 116.67 124.13 1dnu s ASP 79 Ca 0.60 1.00 0.23 0.00 2.13 0.00 0.00 52.55 56.51 1dnu s ASP 79 Cb -0.35 -2.54 0.98 0.00 -1.45 0.00 0.00 42.92 39.56 1dnu s ASP 79 CO 0.33 -1.39 1.69 0.00 0.13 0.00 0.00 175.17 175.92 1dnu n GLN 80 N 7.96 0.18 -0.30 4.34 6.02 -1.26 -3.05 117.38 131.27 1dnu n GLN 80 Ca 0.17 0.45 0.07 0.00 -0.01 0.00 0.00 57.00 57.68 1dnu n GLN 80 Cb 0.47 -1.87 0.11 0.00 1.02 0.00 0.00 30.24 29.98 1dnu n GLN 80 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1dnu n GLU 81 N -2.20 0.95 -3.86 -1.09 1.02 -1.26 -5.00 120.64 109.20 1dnu n GLU 81 Ca 0.02 -2.26 -0.12 0.00 -0.02 0.00 0.00 57.16 54.77 1dnu n GLU 81 Cb 0.20 -1.21 -0.14 0.00 -0.02 0.00 0.00 31.44 30.27 1dnu n GLU 81 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1dnu s ARG 82 N -2.11 0.03 0.50 3.49 1.81 -1.17 -5.16 118.95 116.35 1dnu s ARG 82 Ca 0.25 0.04 -0.02 0.00 -1.72 0.00 0.00 55.73 54.28 1dnu s ARG 82 Cb 0.23 0.01 -0.00 0.00 -0.45 0.00 0.00 34.95 34.73 1dnu s ARG 82 CO 0.00 -0.01 0.76 -1.54 -0.68 0.00 0.00 175.30 173.83 1dnu s SER 83 N 0.05 5.78 0.57 0.23 1.04 -1.26 -4.71 113.70 115.40 1dnu s SER 83 Ca -0.00 0.49 0.35 0.00 0.48 0.00 0.00 55.95 57.27 1dnu s SER 83 Cb -0.01 -1.66 1.71 0.00 0.10 0.00 0.00 66.02 66.16 1dnu s SER 83 CO -0.00 -0.82 2.13 0.25 0.98 0.00 0.00 173.24 175.78 1dnu h LEU 84 N 0.18 0.00 -1.95 2.42 5.85 -2.01 -1.00 115.31 118.79 1dnu h LEU 84 Ca -0.46 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.24 1dnu h LEU 84 Cb 1.25 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 1dnu h LEU 84 CO 0.59 0.05 -0.11 -0.03 -0.34 0.00 0.00 178.44 178.59 1dnu h MET 85 N 0.00 0.00 -0.77 1.25 4.05 -1.99 -1.46 114.93 116.02 1dnu h MET 85 Ca -0.00 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1dnu h MET 85 Cb 0.31 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.07 1dnu h MET 85 CO 0.01 0.11 0.41 0.35 0.23 0.00 0.00 176.91 178.01 1dnu h PHE 86 N 0.00 1.08 -0.12 1.39 3.57 -1.56 0.61 116.94 121.90 1dnu h PHE 86 Ca -0.00 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1dnu h PHE 86 Cb 0.26 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 38.65 1dnu h PHE 86 CO 0.00 0.77 -0.03 1.98 -2.23 0.00 0.00 178.31 178.80 1dnu h MET 87 N 1.08 0.24 -0.62 1.11 4.05 -1.43 -3.16 114.93 116.20 1dnu h MET 87 Ca 0.27 -0.09 -0.04 0.00 -0.28 0.00 0.00 59.70 59.55 1dnu h MET 87 Cb 0.06 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.82 1dnu h MET 87 CO -0.04 0.54 0.21 0.37 0.23 0.00 0.00 176.91 178.22 1dnu h GLN 88 N -0.07 0.94 -0.33 0.39 5.75 -0.91 -1.90 115.11 118.97 1dnu h GLN 88 Ca 0.03 -0.19 -0.02 0.00 -0.15 0.00 0.00 58.65 58.33 1dnu h GLN 88 Cb 0.45 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.84 1dnu h GLN 88 CO 0.01 0.82 0.14 2.35 -2.65 0.00 0.00 178.83 179.50 1dnu h TRP 89 N 0.87 0.46 -0.30 3.99 2.91 -0.99 -1.40 115.95 121.49 1dnu h TRP 89 Ca 0.20 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.20 1dnu h TRP 89 Cb 0.25 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 28.74 1dnu h TRP 89 CO 0.02 0.36 0.15 0.78 -1.03 0.00 0.00 178.44 178.71 1dnu h GLY 90 N 0.61 0.46 0.91 2.65 0.00 -1.32 0.12 103.07 106.50 1dnu h GLY 90 Ca 0.12 -0.22 -0.04 0.00 0.00 0.00 0.00 47.33 47.18 1dnu h GLY 90 CO -0.01 0.21 0.06 -1.61 0.00 0.00 0.00 176.54 175.19 1dnu h GLN 91 N 0.35 0.58 -0.32 4.80 4.15 -1.18 0.09 115.11 123.59 1dnu h GLN 91 Ca 0.10 -0.16 0.02 0.00 0.77 0.00 0.00 58.65 59.39 1dnu h GLN 91 Cb 0.11 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 1dnu h GLN 91 CO -0.01 0.66 0.15 1.25 -1.93 0.00 0.00 178.83 178.94 1dnu h LEU 92 N 0.42 0.21 -0.62 -2.39 5.85 -1.12 -2.05 115.31 115.61 1dnu h LEU 92 Ca 0.11 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 1dnu h LEU 92 Cb 0.35 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1dnu h LEU 92 CO 0.01 0.16 0.21 0.25 -0.34 0.00 0.00 178.44 178.73 1dnu h LEU 93 N 0.31 0.90 -1.08 2.25 5.85 -0.69 -2.17 115.31 120.68 1dnu h LEU 93 Ca 0.13 -0.20 0.10 0.00 0.84 0.00 0.00 57.88 58.76 1dnu h LEU 93 Cb 0.06 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 40.78 1dnu h LEU 93 CO -0.10 0.85 0.62 -0.78 -0.34 0.00 0.00 178.44 178.69 1dnu h ASP 94 N 0.89 0.91 0.37 1.25 3.58 -0.71 0.29 116.42 123.01 1dnu h ASP 94 Ca 0.20 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.68 1dnu h ASP 94 Cb 0.27 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.16 1dnu h ASP 94 CO -0.01 0.53 0.00 1.41 -2.88 0.00 0.00 179.24 178.29 1dnu n HIS 95 N -4.56 0.00 0.05 0.28 8.25 -0.79 -0.76 115.22 117.68 1dnu n HIS 95 Ca 0.17 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.65 1dnu n HIS 95 Cb 0.30 -0.23 -0.07 0.00 1.12 0.00 0.00 29.99 31.12 1dnu n HIS 95 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1dnu n ASP 96 N -1.23 0.85 -0.13 0.41 4.64 0.05 -4.68 116.55 116.46 1dnu n ASP 96 Ca 0.13 0.36 -0.28 0.00 -1.38 0.00 0.00 54.79 53.63 1dnu n ASP 96 Cb 0.18 0.23 -0.10 0.00 -1.04 0.00 0.00 41.12 40.38 1dnu n ASP 96 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 1dnu n LEU 97 N -2.84 2.05 -3.75 -2.67 4.77 -0.11 -5.03 117.00 109.41 1dnu n LEU 97 Ca -0.08 0.31 -0.13 0.00 -0.03 0.00 0.00 56.01 56.08 1dnu n LEU 97 Cb 0.78 -0.86 -0.10 0.00 -2.33 0.00 0.00 43.42 40.91 1dnu n LEU 97 CO 0.42 0.57 0.03 1.51 -1.33 0.00 0.00 177.39 178.59 1dnu s ASP 98 N -7.31 -0.34 -0.05 -1.43 -4.77 0.06 -5.12 116.67 97.71 1dnu s ASP 98 Ca -0.37 0.59 -0.02 0.00 -3.30 0.00 0.00 52.55 49.45 1dnu s ASP 98 Cb 0.13 0.64 0.03 0.00 -1.09 0.00 0.00 42.92 42.63 1dnu s ASP 98 CO 0.52 -0.20 0.08 0.12 0.70 0.00 0.00 175.17 176.40 1dnu s PHE 99 N -0.14 -0.00 -0.48 2.11 5.36 -1.26 -4.58 117.98 118.98 1dnu s PHE 99 Ca -0.03 0.33 -0.14 0.00 -0.96 0.00 0.00 56.93 56.13 1dnu s PHE 99 Cb -0.03 -0.39 0.09 0.00 -0.34 0.00 0.00 43.02 42.35 1dnu s PHE 99 CO 0.01 -0.20 0.39 0.99 -1.46 0.00 0.00 175.22 174.96 1dnu s THR 100 N 2.04 4.98 0.60 0.12 2.01 -1.26 -5.06 115.64 119.08 1dnu s THR 100 Ca 0.03 -1.27 -0.19 0.00 0.31 0.00 0.00 61.69 60.57 1dnu s THR 100 Cb -0.12 -4.05 -0.03 0.00 0.01 0.00 0.00 72.50 68.30 1dnu s THR 100 CO -0.04 -0.64 1.25 -2.16 -0.69 0.00 0.00 174.62 172.34 1dnu s PRO 101 N 1.58 2.88 0.12 4.92 0.04 -1.26 -5.07 135.00 138.21 1dnu s PRO 101 Ca 0.04 1.94 0.03 0.00 0.04 0.00 0.00 61.00 63.05 1dnu s PRO 101 Cb -0.25 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 1dnu s PRO 101 CO 0.05 -1.30 -0.08 -1.21 0.04 0.00 0.00 177.00 174.49 1dnu s GLU 102 N -3.28 0.92 0.61 4.56 2.02 -1.26 -5.15 118.70 117.13 1dnu s GLU 102 Ca 0.78 -1.36 -0.16 0.00 0.02 0.00 0.00 54.97 54.26 1dnu s GLU 102 Cb -0.34 -0.41 -0.02 0.00 0.10 0.00 0.00 34.13 33.46 1dnu s GLU 102 CO 0.37 0.03 1.09 -1.25 0.02 0.00 0.00 175.26 175.52 1dnu s PRO 103 N -3.66 3.09 0.00 0.39 0.04 -1.26 -5.34 135.00 128.26 1dnu s PRO 103 Ca 0.13 1.36 0.30 0.00 0.04 0.00 0.00 61.00 62.82 1dnu s PRO 103 Cb 0.03 -1.99 1.45 0.00 0.04 0.00 0.00 34.50 34.03 1dnu s PRO 103 CO -0.02 -1.02 1.97 0.00 0.04 0.00 0.00 177.00 177.97