#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgp h SER 42 N 0.00 -0.30 0.12 1.61 0.02 -2.10 -2.03 113.55 110.87 2dgp h SER 42 Ca 0.00 0.14 0.01 0.00 -0.84 0.00 0.00 61.79 61.10 2dgp h SER 42 Cb 0.00 0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 2dgp h SER 42 CO 0.00 -0.11 -0.18 -1.28 -1.14 0.00 0.00 176.83 174.12 2dgp h SER 43 N 0.08 -0.49 -1.64 3.07 0.87 -2.08 -3.48 113.55 109.88 2dgp h SER 43 Ca 0.27 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 2dgp h SER 43 Cb 0.42 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2dgp h SER 43 CO -0.48 -0.26 0.00 0.61 -0.53 0.00 0.00 176.83 176.17 2dgp n GLY 44 N -1.31 3.05 0.11 5.77 0.00 -0.76 -5.03 105.19 107.01 2dgp n GLY 44 Ca -0.07 -1.26 -0.20 0.00 0.00 0.00 0.00 46.02 44.49 2dgp n GLY 44 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dgp n SER 45 N 0.00 1.87 -3.66 1.61 2.88 -1.26 -3.72 113.62 111.34 2dgp n SER 45 Ca 0.00 0.44 -0.06 0.00 -1.33 0.00 0.00 58.87 57.92 2dgp n SER 45 Cb 0.00 -0.92 -0.07 0.00 -0.75 0.00 0.00 64.21 62.47 2dgp n SER 45 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dgp s SER 46 N -6.78 -0.68 0.35 -3.46 0.01 -1.26 -5.00 113.70 96.89 2dgp s SER 46 Ca -0.29 1.25 0.00 0.00 1.31 0.00 0.00 55.95 58.23 2dgp s SER 46 Cb 0.07 1.68 0.00 0.00 0.21 0.00 0.00 66.02 67.98 2dgp s SER 46 CO 0.51 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.55 2dgp n GLY 47 N 5.24 -1.32 3.37 3.44 0.00 -1.26 -5.17 105.19 109.48 2dgp n GLY 47 Ca -0.12 0.25 -0.10 0.00 0.00 0.00 0.00 46.02 46.06 2dgp n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dgp s MET 48 N -1.81 1.15 0.38 1.61 1.00 -1.26 -5.15 119.30 115.22 2dgp s MET 48 Ca 0.00 -0.96 -0.26 0.00 0.00 0.00 0.00 55.69 54.47 2dgp s MET 48 Cb 0.00 0.43 -0.09 0.00 0.00 0.00 0.00 34.83 35.17 2dgp s MET 48 CO 0.00 -0.44 1.17 -1.59 0.00 0.00 0.00 175.02 174.16 2dgp s LYS 49 N -3.89 4.17 0.52 2.03 0.00 -1.26 -5.03 119.74 116.28 2dgp s LYS 49 Ca 0.10 1.87 -0.10 0.00 0.00 0.00 0.00 55.97 57.84 2dgp s LYS 49 Cb 0.02 -2.79 -0.05 0.00 0.00 0.00 0.00 37.83 35.02 2dgp s LYS 49 CO -0.05 -0.23 0.90 0.34 0.00 0.00 0.00 175.35 176.31 2dgp s ASP 50 N -1.04 6.34 0.27 0.03 2.15 -1.21 -4.92 116.67 118.30 2dgp s ASP 50 Ca 0.54 1.23 0.11 0.00 0.43 0.00 0.00 52.55 54.87 2dgp s ASP 50 Cb -0.32 -2.38 0.88 0.00 -0.30 0.00 0.00 42.92 40.81 2dgp s ASP 50 CO 0.40 -0.66 1.22 1.57 -0.17 0.00 0.00 175.17 177.53 2dgp n HIS 51 N -2.18 0.76 -1.78 -5.34 -0.00 -1.26 -3.62 115.22 101.79 2dgp n HIS 51 Ca 0.04 0.92 -0.19 0.00 -0.00 0.00 0.00 57.72 58.48 2dgp n HIS 51 Cb 0.54 -1.24 -0.06 0.00 -0.00 0.00 0.00 29.99 29.23 2dgp n HIS 51 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2dgp s ASP 52 N -4.76 4.44 -0.18 0.26 1.11 -1.26 -4.90 116.67 111.38 2dgp s ASP 52 Ca -0.08 -0.27 0.01 0.00 0.18 0.00 0.00 52.55 52.39 2dgp s ASP 52 Cb 0.25 -2.55 0.02 0.00 1.07 0.00 0.00 42.92 41.71 2dgp s ASP 52 CO 0.60 -3.38 -0.19 0.00 1.18 0.00 0.00 175.17 173.38 2dgp s ALA 53 N 12.72 2.31 -0.10 5.23 0.00 -1.24 -4.03 121.76 136.65 2dgp s ALA 53 Ca 0.83 -1.23 -0.00 0.00 0.00 0.00 0.00 51.96 51.55 2dgp s ALA 53 Cb -0.10 -1.20 -0.02 0.00 0.00 0.00 0.00 23.12 21.80 2dgp s ALA 53 CO 0.04 -0.40 -0.09 0.42 0.00 0.00 0.00 175.76 175.73 2dgp s ILE 54 N 1.29 3.51 -0.80 0.00 1.01 -1.26 -5.04 121.20 119.92 2dgp s ILE 54 Ca 0.04 -0.52 -0.15 0.00 0.00 0.00 0.00 60.65 60.01 2dgp s ILE 54 Cb -0.13 -2.46 0.19 0.00 0.01 0.00 0.00 42.46 40.06 2dgp s ILE 54 CO -0.12 0.55 0.80 -0.75 0.00 0.00 0.00 174.94 175.42 2dgp s LYS 55 N -0.22 3.50 -0.08 2.79 2.20 -1.26 -4.14 119.74 122.53 2dgp s LYS 55 Ca 0.02 -2.17 -0.30 0.00 -0.36 0.00 0.00 55.97 53.16 2dgp s LYS 55 Cb -0.13 -4.49 -0.03 0.00 -1.51 0.00 0.00 37.83 31.67 2dgp s LYS 55 CO 0.03 -1.40 1.29 -0.51 -0.36 0.00 0.00 175.35 174.40 2dgp s LEU 56 N 0.95 4.26 -0.28 5.43 1.43 -0.06 -1.51 118.68 128.90 2dgp s LEU 56 Ca 0.19 1.86 -0.16 0.00 -1.03 0.00 0.00 54.13 54.99 2dgp s LEU 56 Cb -0.12 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.52 2dgp s LEU 56 CO -0.07 -0.69 0.42 0.12 0.23 0.00 0.00 176.35 176.36 2dgp s PHE 57 N 2.78 3.24 -0.10 0.29 5.36 0.14 -1.30 117.98 128.39 2dgp s PHE 57 Ca 0.58 0.43 -0.04 0.00 -0.96 0.00 0.00 56.93 56.94 2dgp s PHE 57 Cb -0.26 -2.64 -0.04 0.00 -0.34 0.00 0.00 43.02 39.75 2dgp s PHE 57 CO 0.21 -0.27 0.08 0.42 -1.46 0.00 0.00 175.22 174.20 2dgp s ILE 58 N 2.15 4.99 0.36 3.12 -1.09 -0.46 -2.28 121.20 127.98 2dgp s ILE 58 Ca 0.17 -0.02 0.05 0.00 -2.23 0.00 0.00 60.65 58.62 2dgp s ILE 58 Cb -0.16 -3.16 -0.02 0.00 -1.58 0.00 0.00 42.46 37.54 2dgp s ILE 58 CO 0.10 0.59 0.19 0.61 -1.23 0.00 0.00 174.94 175.19 2dgp n GLY 59 N 1.96 3.17 3.25 6.18 0.00 -0.86 -1.98 105.19 116.90 2dgp n GLY 59 Ca -0.19 -2.02 -0.15 0.00 0.00 0.00 0.00 46.02 43.66 2dgp n GLY 59 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dgp n GLN 60 N -0.76 -4.33 -4.49 1.61 1.13 -1.25 -3.41 117.38 105.89 2dgp n GLN 60 Ca -0.01 0.82 -0.23 0.00 -1.94 0.00 0.00 57.00 55.65 2dgp n GLN 60 Cb 0.57 -5.68 -0.16 0.00 0.11 0.00 0.00 30.24 25.08 2dgp n GLN 60 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2dgp s ILE 61 N -3.36 0.96 0.84 5.09 1.01 -1.26 -4.67 121.20 119.80 2dgp s ILE 61 Ca 0.21 -0.41 -0.11 0.00 0.00 0.00 0.00 60.65 60.34 2dgp s ILE 61 Cb -0.03 -0.87 0.09 0.00 0.01 0.00 0.00 42.46 41.67 2dgp s ILE 61 CO 0.70 0.30 1.09 -2.16 0.00 0.00 0.00 174.94 174.88 2dgp s PRO 62 N 0.44 1.75 -0.48 2.79 0.04 -1.26 -4.61 135.00 133.67 2dgp s PRO 62 Ca -0.09 0.99 -0.02 0.00 0.04 0.00 0.00 61.00 61.92 2dgp s PRO 62 Cb -0.12 -1.85 0.22 0.00 0.04 0.00 0.00 34.50 32.79 2dgp s PRO 62 CO 0.02 -1.95 2.27 2.89 0.04 0.00 0.00 177.00 180.27 2dgp n ARG 63 N -3.71 2.26 -0.05 4.56 1.85 -1.26 -3.93 116.66 116.39 2dgp n ARG 63 Ca 0.08 -2.34 0.00 0.00 -1.00 0.00 0.00 57.85 54.59 2dgp n ARG 63 Cb 0.54 -1.98 0.01 0.00 -1.05 0.00 0.00 32.46 29.98 2dgp n ARG 63 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 2dgp n ASN 64 N 0.19 0.61 -5.02 2.89 2.04 -1.26 -5.07 115.26 109.64 2dgp n ASN 64 Ca 0.45 -1.43 -0.19 0.00 -0.44 0.00 0.00 54.58 52.97 2dgp n ASN 64 Cb 0.55 -0.03 0.04 0.00 -2.53 0.00 0.00 39.78 37.81 2dgp n ASN 64 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 2dgp s LEU 65 N -0.37 3.20 0.26 -4.53 1.43 -1.25 -5.14 118.68 112.28 2dgp s LEU 65 Ca 0.01 -0.78 0.03 0.00 -1.03 0.00 0.00 54.13 52.36 2dgp s LEU 65 Cb 0.01 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2dgp s LEU 65 CO 0.00 -1.18 0.20 -0.62 0.23 0.00 0.00 176.35 174.98 2dgp s ASP 66 N -4.56 0.84 0.09 2.29 2.15 -1.26 -5.05 116.67 111.17 2dgp s ASP 66 Ca 0.58 -1.55 -0.13 0.00 0.43 0.00 0.00 52.55 51.88 2dgp s ASP 66 Cb -0.06 0.46 -0.20 0.00 -0.30 0.00 0.00 42.92 42.82 2dgp s ASP 66 CO 0.36 -0.95 1.22 -0.33 -0.17 0.00 0.00 175.17 175.31 2dgp h GLU 67 N 2.40 0.69 0.00 4.34 3.07 -2.00 -2.02 114.58 121.05 2dgp h GLU 67 Ca -0.31 -0.71 0.00 0.00 -0.50 0.00 0.00 59.36 57.85 2dgp h GLU 67 Cb 1.24 0.19 0.00 0.00 -0.84 0.00 0.00 28.75 29.34 2dgp h GLU 67 CO 0.45 1.29 0.00 -0.22 -1.40 0.00 0.00 179.01 179.13 2dgp h LYS 68 N 0.40 0.00 0.00 2.33 1.63 -1.99 0.27 116.57 119.22 2dgp h LYS 68 Ca -0.11 0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 59.63 2dgp h LYS 68 Cb 1.64 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.26 2dgp h LYS 68 CO 0.19 0.00 -1.31 -0.25 -3.45 0.00 0.00 179.45 174.63 2dgp n ASP 69 N -3.07 0.71 -0.07 4.20 9.92 -1.19 -4.18 116.55 122.86 2dgp n ASP 69 Ca 0.01 0.29 -0.13 0.00 -0.53 0.00 0.00 54.79 54.43 2dgp n ASP 69 Cb 0.34 0.59 -0.14 0.00 -0.64 0.00 0.00 41.12 41.27 2dgp n ASP 69 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2dgp n LEU 70 N -2.69 1.14 -0.24 0.64 4.77 -0.77 -4.33 117.00 115.52 2dgp n LEU 70 Ca -0.05 0.12 0.04 0.00 -0.03 0.00 0.00 56.01 56.09 2dgp n LEU 70 Cb 0.66 -0.07 0.17 0.00 -2.33 0.00 0.00 43.42 41.85 2dgp n LEU 70 CO 0.42 0.59 1.01 0.50 -1.33 0.00 0.00 177.39 178.58 2dgp h LYS 71 N 0.01 0.43 -0.13 3.23 3.64 -0.63 -2.85 116.57 120.26 2dgp h LYS 71 Ca -0.46 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 58.91 2dgp h LYS 71 Cb 2.09 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 33.77 2dgp h LYS 71 CO 0.03 0.28 -0.37 -1.35 -2.27 0.00 0.00 179.45 175.77 2dgp h PRO 72 N 0.44 -0.35 0.00 1.90 0.11 -1.75 1.02 132.00 133.36 2dgp h PRO 72 Ca 0.39 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.52 2dgp h PRO 72 Cb 0.56 0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.75 2dgp h PRO 72 CO -0.38 -0.24 0.00 1.28 -0.21 0.00 0.00 178.00 178.46 2dgp n LEU 73 N -4.51 0.00 0.32 2.35 4.77 -1.08 -0.67 117.00 118.18 2dgp n LEU 73 Ca -0.04 0.75 -0.18 0.00 -0.03 0.00 0.00 56.01 56.52 2dgp n LEU 73 Cb 0.25 -0.28 -0.09 0.00 -2.33 0.00 0.00 43.42 40.97 2dgp n LEU 73 CO 0.05 -0.28 0.59 -0.26 -1.33 0.00 0.00 177.39 176.15 2dgp h PHE 74 N 0.00 -1.11 -1.61 -1.77 0.04 -1.58 -1.92 116.94 109.00 2dgp h PHE 74 Ca 0.00 -0.00 0.47 0.00 2.80 0.00 0.00 57.97 61.23 2dgp h PHE 74 Cb 0.00 0.41 -0.07 0.00 2.20 0.00 0.00 35.95 38.50 2dgp h PHE 74 CO -0.53 -0.60 1.15 -1.91 -0.60 0.00 0.00 178.31 175.82 2dgp n GLU 75 N -5.53 -0.00 -0.03 1.51 2.13 0.35 0.25 120.64 119.31 2dgp n GLU 75 Ca -0.12 0.88 -0.15 0.00 0.66 0.00 0.00 57.16 58.43 2dgp n GLU 75 Cb 0.42 -2.04 -0.09 0.00 0.27 0.00 0.00 31.44 30.01 2dgp n GLU 75 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2dgp h GLU 76 N 0.00 0.35 0.02 5.31 4.57 -0.05 -3.34 114.58 121.44 2dgp h GLU 76 Ca 0.77 -0.27 -0.15 0.00 -1.18 0.00 0.00 59.36 58.53 2dgp h GLU 76 Cb 3.07 0.05 0.01 0.00 -0.16 0.00 0.00 28.75 31.72 2dgp h GLU 76 CO -0.02 0.90 -0.61 0.74 -1.18 0.00 0.00 179.01 178.84 2dgp h PHE 77 N -0.13 0.57 -3.82 0.92 0.04 0.33 -3.47 116.94 111.38 2dgp h PHE 77 Ca -0.02 -0.33 -0.17 0.00 2.80 0.00 0.00 57.97 60.26 2dgp h PHE 77 Cb 0.94 -0.06 -0.22 0.00 2.20 0.00 0.00 35.95 38.81 2dgp h PHE 77 CO 0.12 1.16 -0.65 0.20 -0.60 0.00 0.00 178.31 178.54 2dgp s GLY 78 N -4.12 0.16 -0.93 -1.45 0.00 0.95 -4.91 107.32 97.01 2dgp s GLY 78 Ca -0.13 -0.39 -0.24 0.00 0.00 0.00 0.00 44.72 43.96 2dgp s GLY 78 CO 0.82 -0.46 1.91 1.25 0.00 0.00 0.00 173.10 176.61 2dgp s LYS 79 N -1.23 2.63 0.18 2.90 2.20 -1.26 -3.22 119.74 121.94 2dgp s LYS 79 Ca -0.13 -0.41 -0.30 0.00 -0.36 0.00 0.00 55.97 54.76 2dgp s LYS 79 Cb -0.08 -5.10 -0.17 0.00 -1.51 0.00 0.00 37.83 30.98 2dgp s LYS 79 CO -0.00 -3.33 0.76 -0.89 -0.36 0.00 0.00 175.35 171.53 2dgp n ILE 80 N 7.80 1.59 -0.09 5.43 5.41 -1.26 -2.95 119.36 135.29 2dgp n ILE 80 Ca 0.40 -0.40 -0.13 0.00 1.00 0.00 0.00 62.75 63.63 2dgp n ILE 80 Cb 0.47 -0.27 -0.10 0.00 -0.71 0.00 0.00 39.64 39.03 2dgp n ILE 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2dgp n TYR 81 N 0.42 0.00 -3.28 1.39 9.36 -0.03 -4.79 117.16 120.23 2dgp n TYR 81 Ca 0.16 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.41 2dgp n TYR 81 Cb 0.24 -0.76 -0.02 0.00 -0.63 0.00 0.00 39.34 38.17 2dgp n TYR 81 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 2dgp s GLU 82 N -2.39 0.55 -0.11 2.98 2.12 -1.24 -5.04 118.70 115.57 2dgp s GLU 82 Ca -0.23 1.09 -0.03 0.00 0.36 0.00 0.00 54.97 56.15 2dgp s GLU 82 Cb 0.06 0.62 -0.03 0.00 0.26 0.00 0.00 34.13 35.04 2dgp s GLU 82 CO 0.48 -0.48 0.02 -1.17 -0.54 0.00 0.00 175.26 173.58 2dgp s LEU 83 N 2.86 3.69 -0.08 2.70 2.96 -1.26 -3.05 118.68 126.50 2dgp s LEU 83 Ca 0.13 0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 54.16 2dgp s LEU 83 Cb -0.14 -1.87 0.05 0.00 0.50 0.00 0.00 46.19 44.73 2dgp s LEU 83 CO -0.20 0.33 0.17 -0.89 -1.32 0.00 0.00 176.35 174.44 2dgp s THR 84 N -0.61 -0.22 -0.78 3.68 2.01 -0.87 -5.05 115.64 113.80 2dgp s THR 84 Ca 0.10 0.30 -0.21 0.00 0.31 0.00 0.00 61.69 62.20 2dgp s THR 84 Cb -0.12 -0.30 0.10 0.00 0.01 0.00 0.00 72.50 72.19 2dgp s THR 84 CO 0.02 0.13 1.03 -0.69 -0.69 0.00 0.00 174.62 174.42 2dgp s VAL 85 N 2.00 4.49 -0.74 3.82 1.01 -1.26 -1.10 120.40 128.62 2dgp s VAL 85 Ca -0.00 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 60.79 2dgp s VAL 85 Cb -0.12 -4.73 -0.15 0.00 0.00 0.00 0.00 36.38 31.38 2dgp s VAL 85 CO -0.06 -1.48 2.54 0.18 0.00 0.00 0.00 175.10 176.28 2dgp n LEU 86 N 7.22 1.25 -3.92 3.92 4.77 -1.11 -4.89 117.00 124.24 2dgp n LEU 86 Ca 0.08 -0.07 -0.17 0.00 -0.03 0.00 0.00 56.01 55.82 2dgp n LEU 86 Cb 0.47 -1.21 -0.15 0.00 -2.33 0.00 0.00 43.42 40.20 2dgp n LEU 86 CO 0.58 -1.07 -0.40 -1.59 -1.33 0.00 0.00 177.39 173.59 2dgp s LYS 87 N 8.44 0.51 0.92 3.23 -2.85 -1.26 -3.96 119.74 124.77 2dgp s LYS 87 Ca 1.19 -0.13 -0.15 0.00 -1.00 0.00 0.00 55.97 55.88 2dgp s LYS 87 Cb -0.80 -0.53 0.16 0.00 -2.06 0.00 0.00 37.83 34.60 2dgp s LYS 87 CO 0.40 0.03 1.26 0.34 0.10 0.00 0.00 175.35 177.49 2dgp s ASP 88 N 0.29 3.53 0.00 0.03 -1.08 0.65 -4.98 116.67 115.11 2dgp s ASP 88 Ca -0.03 0.47 0.00 0.00 -0.52 0.00 0.00 52.55 52.47 2dgp s ASP 88 Cb -0.07 -0.69 0.00 0.00 -1.46 0.00 0.00 42.92 40.71 2dgp s ASP 88 CO -0.00 -2.49 0.20 0.54 0.52 0.00 0.00 175.17 173.93 2dgp n ARG 89 N -3.65 1.27 -0.00 4.34 1.74 -1.26 -4.34 116.66 114.76 2dgp n ARG 89 Ca 0.12 -0.20 -0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2dgp n ARG 89 Cb 0.60 -0.63 -0.00 0.00 -1.02 0.00 0.00 32.46 31.41 2dgp n ARG 89 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2dgp n PHE 90 N -0.24 0.00 0.00 -1.55 3.01 -1.26 -4.98 117.46 112.44 2dgp n PHE 90 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2dgp n PHE 90 Cb 0.06 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.51 2dgp n PHE 90 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40 2dgp n THR 91 N -2.58 0.00 -0.64 4.37 5.66 -1.26 -4.82 114.28 115.01 2dgp n THR 91 Ca -0.00 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.93 2dgp n THR 91 Cb 0.02 -0.44 -0.09 0.00 -1.55 0.00 0.00 70.33 68.27 2dgp n THR 91 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2dgp n GLY 92 N 2.12 2.35 0.24 1.09 0.00 -1.26 -4.63 105.19 105.10 2dgp n GLY 92 Ca 0.00 -0.64 0.05 0.00 0.00 0.00 0.00 46.02 45.44 2dgp n GLY 92 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dgp n MET 93 N 2.32 -0.06 -3.38 1.61 2.81 -1.26 -0.25 117.12 118.91 2dgp n MET 93 Ca 0.23 1.04 -0.26 0.00 -1.81 0.00 0.00 57.70 56.90 2dgp n MET 93 Cb 0.60 -1.57 -0.09 0.00 -0.71 0.00 0.00 33.22 31.44 2dgp n MET 93 CO 0.00 0.00 0.00 1.58 1.51 0.00 0.00 175.97 179.06 2dgp n HIS 94 N -5.06 0.38 -0.24 2.03 -0.00 -1.26 -3.29 115.22 107.78 2dgp n HIS 94 Ca 0.12 -3.63 0.15 0.00 0.46 0.00 0.00 57.72 54.81 2dgp n HIS 94 Cb 0.37 -0.19 0.28 0.00 -0.12 0.00 0.00 29.99 30.34 2dgp n HIS 94 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 2dgp n LYS 95 N 1.92 -0.05 0.00 1.57 5.02 -0.96 -4.73 118.16 120.93 2dgp n LYS 95 Ca 0.25 1.02 0.00 0.00 -2.02 0.00 0.00 58.31 57.56 2dgp n LYS 95 Cb 0.47 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 2dgp n LYS 95 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dgp n GLY 96 N -1.29 0.89 3.74 0.72 0.00 -1.26 -5.09 105.19 102.91 2dgp n GLY 96 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.22 2dgp n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dgp s ALA 98 N -2.51 -1.66 -0.20 0.00 0.00 -0.84 -2.75 121.76 113.80 2dgp s ALA 98 Ca 0.17 1.34 -0.10 0.00 0.00 0.00 0.00 51.96 53.37 2dgp s ALA 98 Cb 0.02 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.88 2dgp s ALA 98 CO -0.01 -0.35 0.13 -0.06 0.00 0.00 0.00 175.76 175.47 2dgp s PHE 99 N -0.91 3.40 0.07 0.00 0.08 -0.26 -1.36 117.98 118.99 2dgp s PHE 99 Ca -0.09 0.31 0.09 0.00 0.12 0.00 0.00 56.93 57.36 2dgp s PHE 99 Cb -0.01 -2.17 -0.03 0.00 -0.57 0.00 0.00 43.02 40.23 2dgp s PHE 99 CO 0.08 0.26 -0.23 -1.17 -0.10 0.00 0.00 175.22 174.06 2dgp s LEU 100 N 0.44 2.21 -0.05 -0.37 2.96 -0.42 -2.06 118.68 121.40 2dgp s LEU 100 Ca 0.08 -0.60 0.01 0.00 -0.22 0.00 0.00 54.13 53.39 2dgp s LEU 100 Cb -0.11 -1.08 0.02 0.00 0.50 0.00 0.00 46.19 45.52 2dgp s LEU 100 CO -0.01 0.17 -0.04 -0.89 -1.32 0.00 0.00 176.35 174.26 2dgp s THR 101 N -0.90 0.57 -0.11 3.68 2.01 -1.17 -0.89 115.64 118.82 2dgp s THR 101 Ca 0.09 -0.11 -0.09 0.00 0.31 0.00 0.00 61.69 61.90 2dgp s THR 101 Cb -0.10 -0.61 -0.04 0.00 0.01 0.00 0.00 72.50 71.76 2dgp s THR 101 CO 0.03 0.25 0.19 -0.31 -0.69 0.00 0.00 174.62 174.09 2dgp s TYR 102 N 1.14 3.59 0.23 4.92 2.02 -1.26 -0.85 117.35 127.14 2dgp s TYR 102 Ca -0.07 0.59 -0.06 0.00 -0.37 0.00 0.00 57.07 57.15 2dgp s TYR 102 Cb -0.14 -2.04 0.40 0.00 -0.40 0.00 0.00 41.96 39.77 2dgp s TYR 102 CO -0.01 0.65 1.74 0.00 -1.57 0.00 0.00 175.55 176.35 2dgp s GLU 104 N -6.04 2.67 0.06 0.00 2.02 -1.26 -3.30 118.70 112.84 2dgp s GLU 104 Ca -0.13 -0.62 -0.28 0.00 0.02 0.00 0.00 54.97 53.96 2dgp s GLU 104 Cb 0.19 -2.55 -0.14 0.00 0.10 0.00 0.00 34.13 31.73 2dgp s GLU 104 CO 0.76 0.64 1.43 -0.09 0.02 0.00 0.00 175.26 178.02 2dgp h ARG 105 N 4.96 -0.85 -0.79 1.61 2.43 -1.79 -2.96 114.38 116.99 2dgp h ARG 105 Ca -0.49 0.06 0.14 0.00 -0.81 0.00 0.00 59.98 58.88 2dgp h ARG 105 Cb 1.17 0.19 -0.14 0.00 -0.42 0.00 0.00 29.97 30.77 2dgp h ARG 105 CO 0.53 -0.56 -0.31 1.49 -1.51 0.00 0.00 179.97 179.60 2dgp h GLU 106 N -0.88 -0.06 -0.97 0.20 4.81 -1.96 0.28 114.58 115.99 2dgp h GLU 106 Ca -0.07 0.00 0.34 0.00 -0.13 0.00 0.00 59.36 59.51 2dgp h GLU 106 Cb 0.73 0.01 -0.18 0.00 0.63 0.00 0.00 28.75 29.94 2dgp h GLU 106 CO 0.03 -0.04 0.29 0.45 -0.73 0.00 0.00 179.01 179.00 2dgp n SER 107 N -5.48 0.13 -0.28 1.04 2.88 -1.12 0.16 113.62 110.95 2dgp n SER 107 Ca 0.08 1.63 0.00 0.00 -1.33 0.00 0.00 58.87 59.26 2dgp n SER 107 Cb 0.39 -0.70 0.13 0.00 -0.75 0.00 0.00 64.21 63.28 2dgp n SER 107 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dgp h ALA 108 N 1.95 1.07 -0.03 -1.46 0.00 -0.39 -2.47 119.26 117.93 2dgp h ALA 108 Ca 0.72 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.66 2dgp h ALA 108 Cb 1.73 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 2dgp h ALA 108 CO -0.83 0.14 -0.10 -0.07 0.00 0.00 0.00 179.25 178.40 2dgp h LEU 109 N 0.82 -0.28 0.02 0.00 3.38 0.15 0.10 115.31 119.50 2dgp h LEU 109 Ca 0.35 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.38 2dgp h LEU 109 Cb 0.23 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 2dgp h LEU 109 CO -0.20 -0.14 -0.34 0.11 0.09 0.00 0.00 178.44 177.96 2dgp h LYS 110 N -0.15 -0.43 -0.55 1.13 1.57 -1.22 0.27 116.57 117.19 2dgp h LYS 110 Ca 0.05 0.03 0.15 0.00 -1.87 0.00 0.00 60.65 59.01 2dgp h LYS 110 Cb 0.21 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2dgp h LYS 110 CO -0.12 -0.29 0.39 0.00 -0.57 0.00 0.00 179.45 178.87 2dgp h ALA 111 N -0.84 2.45 0.46 3.86 0.00 -1.42 0.69 119.26 124.46 2dgp h ALA 111 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2dgp h ALA 111 Cb 0.47 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2dgp h ALA 111 CO -0.22 -0.60 -0.22 1.96 0.00 0.00 0.00 179.25 180.17 2dgp h GLN 112 N 0.06 -0.59 0.00 0.00 4.20 0.67 0.31 115.11 119.76 2dgp h GLN 112 Ca 0.26 0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.01 2dgp h GLN 112 Cb 0.98 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.89 2dgp h GLN 112 CO -0.02 -0.39 0.00 0.43 -0.67 0.00 0.00 178.83 178.18 2dgp n SER 113 N -4.57 0.00 -0.01 1.46 7.64 0.78 0.64 113.62 119.57 2dgp n SER 113 Ca -0.08 -0.54 0.08 0.00 1.01 0.00 0.00 58.87 59.34 2dgp n SER 113 Cb 0.24 -0.09 -0.12 0.00 -1.01 0.00 0.00 64.21 63.23 2dgp n SER 113 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dgp n ALA 114 N -1.09 2.57 -0.03 -0.43 0.00 0.24 -4.71 120.51 117.05 2dgp n ALA 114 Ca 0.16 -0.36 -0.06 0.00 0.00 0.00 0.00 53.44 53.18 2dgp n ALA 114 Cb 0.12 -0.53 -0.03 0.00 0.00 0.00 0.00 19.45 19.01 2dgp n ALA 114 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dgp n LEU 115 N -2.03 2.16 -4.61 0.00 4.77 0.11 -4.80 117.00 112.60 2dgp n LEU 115 Ca -0.03 0.01 -0.54 0.00 -0.03 0.00 0.00 56.01 55.41 2dgp n LEU 115 Cb 0.40 -0.23 -0.07 0.00 -2.33 0.00 0.00 43.42 41.19 2dgp n LEU 115 CO 0.32 0.46 0.95 1.57 -1.33 0.00 0.00 177.39 179.36 2dgp n HIS 116 N -2.91 1.52 -4.28 -1.77 -0.00 0.21 -0.81 115.22 107.18 2dgp n HIS 116 Ca -0.13 0.68 -0.32 0.00 0.46 0.00 0.00 57.72 58.41 2dgp n HIS 116 Cb 0.62 -2.33 -0.08 0.00 -0.12 0.00 0.00 29.99 28.08 2dgp n HIS 116 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2dgp n GLU 117 N 2.99 -1.46 0.00 1.57 -0.58 -1.24 -4.75 120.64 117.16 2dgp n GLU 117 Ca 0.20 0.17 0.00 0.00 -0.42 0.00 0.00 57.16 57.12 2dgp n GLU 117 Cb 0.16 -4.02 0.00 0.00 -0.57 0.00 0.00 31.44 27.01 2dgp n GLU 117 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2dgp n GLN 118 N -4.46 0.00 -4.69 3.49 6.02 0.01 -5.10 117.38 112.65 2dgp n GLN 118 Ca -0.23 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.46 2dgp n GLN 118 Cb 0.65 -0.51 -0.14 0.00 1.02 0.00 0.00 30.24 31.25 2dgp n GLN 118 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2dgp s LYS 119 N -1.42 1.69 -0.03 -1.09 -2.85 -1.15 -5.06 119.74 109.83 2dgp s LYS 119 Ca 0.00 -1.18 0.06 0.00 -1.00 0.00 0.00 55.97 53.85 2dgp s LYS 119 Cb 0.00 -1.98 -0.01 0.00 -2.06 0.00 0.00 37.83 33.78 2dgp s LYS 119 CO 0.00 0.49 -0.21 0.99 0.10 0.00 0.00 175.35 176.73 2dgp s THR 120 N -0.91 1.66 0.49 3.79 2.01 -1.26 -2.35 115.64 119.07 2dgp s THR 120 Ca 0.13 -0.88 -0.14 0.00 0.31 0.00 0.00 61.69 61.11 2dgp s THR 120 Cb -0.10 -1.39 -0.07 0.00 0.01 0.00 0.00 72.50 70.95 2dgp s THR 120 CO 0.04 0.47 0.93 -0.76 -0.69 0.00 0.00 174.62 174.61 2dgp s LEU 121 N -0.32 3.64 -0.09 4.42 1.43 -1.26 -4.96 118.68 121.55 2dgp s LEU 121 Ca 0.04 1.44 -0.30 0.00 -1.03 0.00 0.00 54.13 54.28 2dgp s LEU 121 Cb -0.10 -4.37 -0.04 0.00 0.03 0.00 0.00 46.19 41.71 2dgp s LEU 121 CO 0.01 -0.56 1.52 -2.16 0.23 0.00 0.00 176.35 175.38 2dgp s PRO 122 N -4.12 4.20 0.00 1.29 0.04 -1.26 -2.87 135.00 132.28 2dgp s PRO 122 Ca 0.56 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.61 2dgp s PRO 122 Cb -0.10 -3.90 0.00 0.00 0.04 0.00 0.00 34.50 30.54 2dgp s PRO 122 CO 0.33 -0.79 0.00 0.41 0.04 0.00 0.00 177.00 176.99 2dgp n GLY 123 N 3.95 1.08 2.63 0.56 0.00 -1.26 -4.98 105.19 107.17 2dgp n GLY 123 Ca 0.16 -0.39 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 2dgp n GLY 123 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dgp s MET 124 N -1.51 0.04 0.49 1.61 -1.94 -1.14 -5.00 119.30 111.85 2dgp s MET 124 Ca 0.00 0.02 0.15 0.00 -1.71 0.00 0.00 55.69 54.15 2dgp s MET 124 Cb 0.00 -1.55 1.18 0.00 2.01 0.00 0.00 34.83 36.47 2dgp s MET 124 CO 0.00 -0.60 2.11 -0.91 -0.01 0.00 0.00 175.02 175.61 2dgp h ASN 125 N 8.42 0.12 -2.69 3.03 4.21 -1.98 -3.42 115.58 123.28 2dgp h ASN 125 Ca -0.14 -0.00 -0.67 0.00 1.21 0.00 0.00 56.30 56.70 2dgp h ASN 125 Cb 1.14 -0.03 -0.07 0.00 -1.12 0.00 0.00 38.32 38.24 2dgp h ASN 125 CO 0.26 0.08 -0.48 -0.60 -1.29 0.00 0.00 177.43 175.40 2dgp s ARG 126 N -5.17 3.46 0.84 0.81 3.52 -1.26 -5.10 118.95 116.05 2dgp s ARG 126 Ca -0.06 -0.14 -0.11 0.00 -0.13 0.00 0.00 55.73 55.29 2dgp s ARG 126 Cb 0.17 -3.19 0.09 0.00 -1.56 0.00 0.00 34.95 30.47 2dgp s ARG 126 CO 0.69 0.76 1.09 -1.25 -0.81 0.00 0.00 175.30 175.78 2dgp s PRO 127 N -0.96 1.73 0.08 5.12 0.04 -1.26 -4.64 135.00 135.10 2dgp s PRO 127 Ca 0.15 0.99 -0.31 0.00 0.04 0.00 0.00 61.00 61.87 2dgp s PRO 127 Cb -0.12 -1.85 -0.08 0.00 0.04 0.00 0.00 34.50 32.49 2dgp s PRO 127 CO 0.04 -1.96 1.63 -1.50 0.04 0.00 0.00 177.00 175.25 2dgp s ILE 128 N -2.92 3.00 -0.19 0.56 2.07 -0.99 -4.87 121.20 117.86 2dgp s ILE 128 Ca 0.62 0.50 -0.11 0.00 -1.41 0.00 0.00 60.65 60.25 2dgp s ILE 128 Cb -0.18 -3.32 -0.05 0.00 0.13 0.00 0.00 42.46 39.04 2dgp s ILE 128 CO 0.56 0.00 0.17 -1.10 -1.91 0.00 0.00 174.94 172.67 2dgp s GLN 129 N 2.43 4.20 -0.24 3.50 1.11 -1.22 -3.71 119.66 125.73 2dgp s GLN 129 Ca 0.73 -0.14 0.00 0.00 0.01 0.00 0.00 55.36 55.96 2dgp s GLN 129 Cb -0.40 -3.43 0.06 0.00 -1.01 0.00 0.00 33.01 28.23 2dgp s GLN 129 CO 0.32 0.26 -0.03 0.08 0.01 0.00 0.00 175.29 175.93 2dgp s VAL 130 N 0.45 1.40 0.00 1.09 1.01 -1.26 -2.02 120.40 121.07 2dgp s VAL 130 Ca 0.10 -1.19 0.01 0.00 0.00 0.00 0.00 61.98 60.90 2dgp s VAL 130 Cb -0.12 -1.73 -0.00 0.00 0.00 0.00 0.00 36.38 34.53 2dgp s VAL 130 CO -0.00 -0.16 -0.02 -1.59 0.00 0.00 0.00 175.10 173.33 2dgp s LYS 131 N 1.45 0.18 -0.25 2.72 -2.85 -0.97 -4.86 119.74 115.16 2dgp s LYS 131 Ca -0.04 -0.13 -0.29 0.00 -1.00 0.00 0.00 55.97 54.51 2dgp s LYS 131 Cb -0.19 -0.13 -0.02 0.00 -2.06 0.00 0.00 37.83 35.43 2dgp s LYS 131 CO -0.07 0.03 1.63 -1.25 0.10 0.00 0.00 175.35 175.79 2dgp s PRO 132 N -0.20 3.72 0.06 1.78 0.04 -1.26 0.28 135.00 139.41 2dgp s PRO 132 Ca -0.01 1.59 -0.22 0.00 0.04 0.00 0.00 61.00 62.40 2dgp s PRO 132 Cb -0.02 -4.06 -0.09 0.00 0.04 0.00 0.00 34.50 30.37 2dgp s PRO 132 CO -0.00 -1.38 1.35 0.00 0.04 0.00 0.00 177.00 177.00 2dgp h ALA 133 N 11.01 -0.86 -3.02 8.56 0.00 -1.60 -3.39 119.26 129.96 2dgp h ALA 133 Ca -0.33 -0.08 -0.58 0.00 0.00 0.00 0.00 54.91 53.91 2dgp h ALA 133 Cb 1.15 0.70 -0.40 0.00 0.00 0.00 0.00 17.79 19.25 2dgp h ALA 133 CO 1.01 -0.93 -0.76 0.34 0.00 0.00 0.00 179.25 178.90 2dgp s ASP 134 N -3.78 3.78 -0.30 0.00 2.15 -1.26 -5.07 116.67 112.20 2dgp s ASP 134 Ca -0.10 -1.90 0.02 0.00 0.43 0.00 0.00 52.55 50.99 2dgp s ASP 134 Cb 0.04 -0.81 0.07 0.00 -0.30 0.00 0.00 42.92 41.92 2dgp s ASP 134 CO 0.38 -0.37 -0.02 -0.94 -0.17 0.00 0.00 175.17 174.04 2dgp s SER 135 N 1.30 4.69 -0.03 -0.34 1.04 -1.26 -4.58 113.70 114.52 2dgp s SER 135 Ca 0.12 -1.58 -0.01 0.00 0.48 0.00 0.00 55.95 54.96 2dgp s SER 135 Cb -0.19 -1.63 0.03 0.00 0.10 0.00 0.00 66.02 64.32 2dgp s SER 135 CO -0.17 -0.28 0.05 -1.61 0.98 0.00 0.00 173.24 172.21 2dgp s GLU 136 N 1.10 -0.00 -1.14 4.02 8.01 -1.26 -5.09 118.70 124.34 2dgp s GLU 136 Ca -0.02 0.20 -0.12 0.00 0.01 0.00 0.00 54.97 55.04 2dgp s GLU 136 Cb -0.20 -0.19 0.22 0.00 -4.31 0.00 0.00 34.13 29.65 2dgp s GLU 136 CO -0.05 -0.14 1.25 0.45 0.01 0.00 0.00 175.26 176.78 2dgp s SER 137 N 0.91 7.17 0.35 -0.19 0.15 -1.26 -5.00 113.70 115.83 2dgp s SER 137 Ca -0.07 -3.25 0.08 0.00 0.70 0.00 0.00 55.95 53.40 2dgp s SER 137 Cb -0.10 -2.30 -0.04 0.00 -1.71 0.00 0.00 66.02 61.86 2dgp s SER 137 CO -0.03 -0.53 0.14 -0.13 1.20 0.00 0.00 173.24 173.89 2dgp s ARG 138 N 0.19 2.35 0.00 5.44 1.81 -1.26 -5.15 118.95 122.32 2dgp s ARG 138 Ca 0.36 -1.58 0.00 0.00 -1.72 0.00 0.00 55.73 52.79 2dgp s ARG 138 Cb -0.07 -2.15 0.00 0.00 -0.45 0.00 0.00 34.95 32.28 2dgp s ARG 138 CO -0.04 0.09 0.00 0.41 -0.68 0.00 0.00 175.30 175.08 2dgp n GLY 139 N -1.15 3.11 0.00 -3.53 0.00 -1.26 -5.09 105.19 97.26 2dgp n GLY 139 Ca -0.03 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.83 2dgp n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dgp n GLY 140 N 5.00 2.35 3.67 -0.02 0.00 -1.26 -5.05 105.19 109.88 2dgp n GLY 140 Ca 0.00 -0.70 -0.49 0.00 0.00 0.00 0.00 46.02 44.83 2dgp n GLY 140 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dgp n SER 141 N 0.00 3.03 -3.06 1.61 2.88 -1.26 -4.95 113.62 111.87 2dgp n SER 141 Ca 0.00 1.04 -0.08 0.00 -1.33 0.00 0.00 58.87 58.50 2dgp n SER 141 Cb 0.00 -1.34 0.08 0.00 -0.75 0.00 0.00 64.21 62.19 2dgp n SER 141 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dgp n GLY 142 N 3.86 -3.68 0.08 0.46 0.00 -1.26 -4.95 105.19 99.71 2dgp n GLY 142 Ca 0.21 -1.21 -0.13 0.00 0.00 0.00 0.00 46.02 44.89 2dgp n GLY 142 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dgp h PRO 143 N 0.00 0.13 -6.66 1.61 0.13 -2.07 -3.47 132.00 121.68 2dgp h PRO 143 Ca -0.10 -0.07 -0.53 0.00 -0.87 0.00 0.00 66.00 64.42 2dgp h PRO 143 Cb 0.34 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.31 2dgp h PRO 143 CO 0.06 0.59 -0.84 0.45 -0.23 0.00 0.00 178.00 178.03 2dgp n SER 144 N -4.74 -2.85 -4.65 1.44 2.88 -1.26 -4.90 113.62 99.54 2dgp n SER 144 Ca -0.08 -0.99 -0.30 0.00 -1.33 0.00 0.00 58.87 56.17 2dgp n SER 144 Cb 0.29 -2.93 0.18 0.00 -0.75 0.00 0.00 64.21 61.00 2dgp n SER 144 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dgp s SER 145 N -3.52 2.69 0.00 -3.46 1.04 -1.26 -5.31 113.70 103.88 2dgp s SER 145 Ca 0.58 1.92 0.17 0.00 0.48 0.00 0.00 55.95 59.10 2dgp s SER 145 Cb -0.31 -2.46 0.13 0.00 0.10 0.00 0.00 66.02 63.48 2dgp s SER 145 CO 0.91 -3.20 1.03 0.61 0.98 0.00 0.00 173.24 173.57