#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e9i s SER 2 N 0.00 0.17 -0.09 1.61 1.04 -1.26 -5.17 113.70 110.00 2e9i s SER 2 Ca 0.00 -0.80 -0.05 0.00 0.48 0.00 0.00 55.95 55.58 2e9i s SER 2 Cb 0.00 0.34 0.04 0.00 0.10 0.00 0.00 66.02 66.50 2e9i s SER 2 CO 0.00 -0.75 0.22 -0.44 0.98 0.00 0.00 173.24 173.26 2e9i s SER 3 N -2.91 -0.23 -0.51 7.02 0.01 -1.26 -5.10 113.70 110.72 2e9i s SER 3 Ca 0.09 0.47 0.07 0.00 1.31 0.00 0.00 55.95 57.89 2e9i s SER 3 Cb 0.05 0.37 0.19 0.00 0.21 0.00 0.00 66.02 66.84 2e9i s SER 3 CO -0.07 -0.15 0.71 -0.83 0.41 0.00 0.00 173.24 173.31 2e9i s GLY 4 N 1.09 -1.14 -0.40 3.44 0.00 -1.26 -5.11 107.32 103.93 2e9i s GLY 4 Ca -0.08 -0.51 -0.18 0.00 0.00 0.00 0.00 44.72 43.95 2e9i s GLY 4 CO -0.07 3.59 0.49 -0.56 0.00 0.00 0.00 173.10 176.55 2e9i s SER 5 N 0.84 6.25 -0.27 1.64 0.01 -1.26 -5.02 113.70 115.88 2e9i s SER 5 Ca 0.30 -0.42 -0.24 0.00 1.31 0.00 0.00 55.95 56.90 2e9i s SER 5 Cb 0.00 -2.25 0.08 0.00 0.21 0.00 0.00 66.02 64.06 2e9i s SER 5 CO -0.06 -0.57 0.77 -0.55 0.41 0.00 0.00 173.24 173.23 2e9i s SER 6 N 1.83 -0.72 -0.08 2.44 0.15 -1.26 -5.18 113.70 110.89 2e9i s SER 6 Ca 0.16 1.37 -0.29 0.00 0.70 0.00 0.00 55.95 57.88 2e9i s SER 6 Cb -0.16 1.38 0.09 0.00 -1.71 0.00 0.00 66.02 65.62 2e9i s SER 6 CO 0.14 -0.23 1.29 0.61 1.20 0.00 0.00 173.24 176.26 2e9i n GLY 7 N 2.73 0.12 4.12 9.45 0.00 -1.26 -5.01 105.19 115.34 2e9i n GLY 7 Ca -0.14 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.56 2e9i n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e9i n ARG 8 N -0.94 -2.97 -3.32 1.61 5.12 -1.26 -4.91 116.66 109.99 2e9i n ARG 8 Ca 0.06 0.35 -0.38 0.00 -1.93 0.00 0.00 57.85 55.95 2e9i n ARG 8 Cb 0.55 -4.70 -0.07 0.00 -1.16 0.00 0.00 32.46 27.09 2e9i n ARG 8 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2e9i s VAL 9 N -3.69 5.17 -0.37 1.55 1.01 -1.26 -5.05 120.40 117.77 2e9i s VAL 9 Ca 0.35 0.86 -0.19 0.00 0.00 0.00 0.00 61.98 63.00 2e9i s VAL 9 Cb -0.19 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.40 2e9i s VAL 9 CO 0.92 0.26 0.56 -0.54 0.00 0.00 0.00 175.10 176.30 2e9i s LYS 10 N 1.15 3.57 0.20 2.72 3.01 -1.26 -4.95 119.74 124.18 2e9i s LYS 10 Ca 0.23 -0.15 -0.12 0.00 -1.01 0.00 0.00 55.97 54.92 2e9i s LYS 10 Cb -0.15 -3.83 0.25 0.00 -1.01 0.00 0.00 37.83 33.08 2e9i s LYS 10 CO 0.09 -0.73 1.68 1.05 0.51 0.00 0.00 175.35 177.95 2e9i h GLU 11 N 8.52 0.14 -6.27 1.68 4.11 -2.04 -3.37 114.58 117.35 2e9i h GLU 11 Ca -0.27 -0.01 -0.58 0.00 0.07 0.00 0.00 59.36 58.57 2e9i h GLU 11 Cb 1.12 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 30.26 2e9i h GLU 11 CO 0.81 0.09 0.78 0.45 0.07 0.00 0.00 179.01 181.21 2e9i s SER 12 N -5.25 6.84 0.27 3.06 0.15 -1.26 -5.02 113.70 112.49 2e9i s SER 12 Ca -0.13 0.89 -0.29 0.00 0.70 0.00 0.00 55.95 57.12 2e9i s SER 12 Cb 0.17 -2.52 -0.09 0.00 -1.71 0.00 0.00 66.02 61.87 2e9i s SER 12 CO 0.73 -0.89 1.00 -0.51 1.20 0.00 0.00 173.24 174.77 2e9i s ILE 13 N 3.64 3.87 -0.55 6.45 2.07 -1.26 -5.02 121.20 130.40 2e9i s ILE 13 Ca 0.43 1.84 -0.09 0.00 -1.41 0.00 0.00 60.65 61.43 2e9i s ILE 13 Cb -0.12 -4.15 0.14 0.00 0.13 0.00 0.00 42.46 38.46 2e9i s ILE 13 CO 0.17 0.41 0.42 0.42 -1.91 0.00 0.00 174.94 174.45 2e9i s THR 14 N -1.23 4.33 0.09 4.00 -4.23 -1.26 -4.96 115.64 112.39 2e9i s THR 14 Ca 0.44 -2.08 -0.33 0.00 -1.18 0.00 0.00 61.69 58.54 2e9i s THR 14 Cb -0.27 -3.82 -0.14 0.00 1.34 0.00 0.00 72.50 69.61 2e9i s THR 14 CO 0.34 -0.83 1.59 0.03 -0.54 0.00 0.00 174.62 175.21 2e9i h ARG 15 N 8.12 -0.80 -6.00 3.99 2.47 -2.06 -3.42 114.38 116.69 2e9i h ARG 15 Ca -0.13 0.05 -0.66 0.00 -1.26 0.00 0.00 59.98 57.98 2e9i h ARG 15 Cb 1.05 0.18 -0.11 0.00 -1.65 0.00 0.00 29.97 29.44 2e9i h ARG 15 CO 0.82 -0.53 -0.58 0.95 0.56 0.00 0.00 179.97 181.19 2e9i s THR 16 N -5.94 4.65 -0.01 2.04 -4.23 -1.26 -5.09 115.64 105.80 2e9i s THR 16 Ca -0.17 -0.38 -0.27 0.00 -1.18 0.00 0.00 61.69 59.68 2e9i s THR 16 Cb 0.06 -3.10 -0.04 0.00 1.34 0.00 0.00 72.50 70.76 2e9i s THR 16 CO 0.62 0.40 0.87 -0.94 -0.54 0.00 0.00 174.62 175.03 2e9i s SER 17 N -1.58 7.24 -0.09 3.99 1.04 -1.26 -4.97 113.70 118.06 2e9i s SER 17 Ca 0.21 1.49 -0.32 0.00 0.48 0.00 0.00 55.95 57.81 2e9i s SER 17 Cb -0.12 -2.51 -0.10 0.00 0.10 0.00 0.00 66.02 63.39 2e9i s SER 17 CO 0.12 -0.18 1.99 -1.14 0.98 0.00 0.00 173.24 175.00 2e9i n ARG 18 N 3.71 2.26 -3.84 4.02 0.63 -1.26 -4.95 116.66 117.23 2e9i n ARG 18 Ca 0.03 0.79 -0.11 0.00 -0.92 0.00 0.00 57.85 57.64 2e9i n ARG 18 Cb 0.51 -2.82 -0.09 0.00 0.45 0.00 0.00 32.46 30.50 2e9i n ARG 18 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2e9i s ALA 19 N 5.08 -0.41 0.66 5.13 0.00 -1.26 -5.16 121.76 125.80 2e9i s ALA 19 Ca 0.94 -0.13 -0.15 0.00 0.00 0.00 0.00 51.96 52.62 2e9i s ALA 19 Cb -0.58 0.18 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 2e9i s ALA 19 CO 0.46 -0.29 1.11 -1.25 0.00 0.00 0.00 175.76 175.80 2e9i s PRO 20 N -1.92 2.80 -0.24 0.00 0.04 -1.26 -4.98 135.00 129.44 2e9i s PRO 20 Ca -0.10 1.39 0.09 0.00 0.04 0.00 0.00 61.00 62.43 2e9i s PRO 20 Cb -0.04 -1.95 0.44 0.00 0.04 0.00 0.00 34.50 32.98 2e9i s PRO 20 CO -0.00 -1.25 1.22 0.43 0.04 0.00 0.00 177.00 177.44 2e9i n SER 21 N -2.41 2.89 -4.77 6.66 7.64 -1.26 -5.04 113.62 117.33 2e9i n SER 21 Ca 0.10 -3.85 -0.39 0.00 1.01 0.00 0.00 58.87 55.74 2e9i n SER 21 Cb 0.52 -0.47 -0.06 0.00 -1.01 0.00 0.00 64.21 63.19 2e9i n SER 21 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2e9i s VAL 22 N -3.72 4.60 -0.27 0.44 -7.23 -1.26 -4.76 120.40 108.20 2e9i s VAL 22 Ca 0.43 1.53 -0.25 0.00 -1.81 0.00 0.00 61.98 61.87 2e9i s VAL 22 Cb 0.39 -4.06 0.12 0.00 0.56 0.00 0.00 36.38 33.39 2e9i s VAL 22 CO -0.03 0.48 1.00 0.00 -0.31 0.00 0.00 175.10 176.24 2e9i s ALA 23 N -0.74 -1.95 0.42 1.32 0.00 -1.26 -5.12 121.76 114.42 2e9i s ALA 23 Ca 0.34 1.87 0.08 0.00 0.00 0.00 0.00 51.96 54.25 2e9i s ALA 23 Cb -0.21 -1.36 -0.01 0.00 0.00 0.00 0.00 23.12 21.53 2e9i s ALA 23 CO 0.23 -0.25 0.42 -0.08 0.00 0.00 0.00 175.76 176.08 2e9i s THR 24 N 0.15 2.72 -0.11 0.00 -1.32 -1.26 -2.80 115.64 113.01 2e9i s THR 24 Ca 0.03 -1.28 0.00 0.00 -1.21 0.00 0.00 61.69 59.23 2e9i s THR 24 Cb -0.05 -2.99 -0.02 0.00 -1.51 0.00 0.00 72.50 67.93 2e9i s THR 24 CO -0.05 0.00 -0.11 0.54 -2.21 0.00 0.00 174.62 172.79 2e9i s VAL 25 N -2.45 3.24 -0.05 5.08 0.11 -1.23 -4.66 120.40 120.44 2e9i s VAL 25 Ca 0.49 -0.61 -0.00 0.00 -2.93 0.00 0.00 61.98 58.93 2e9i s VAL 25 Cb -0.04 -2.35 0.00 0.00 -1.53 0.00 0.00 36.38 32.45 2e9i s VAL 25 CO 0.29 0.54 0.05 0.61 -3.33 0.00 0.00 175.10 173.25 2e9i n GLY 26 N 3.17 0.56 3.57 6.54 0.00 -1.26 -4.87 105.19 112.90 2e9i n GLY 26 Ca -0.18 -0.51 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 2e9i n GLY 26 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2e9i s SER 27 N -3.04 -0.44 -0.52 1.61 0.15 -1.26 -5.10 113.70 105.09 2e9i s SER 27 Ca 0.01 0.52 -0.27 0.00 0.70 0.00 0.00 55.95 56.91 2e9i s SER 27 Cb -0.00 0.41 -0.03 0.00 -1.71 0.00 0.00 66.02 64.69 2e9i s SER 27 CO 0.03 -0.38 1.97 -0.63 1.20 0.00 0.00 173.24 175.44 2e9i s ILE 28 N -0.99 3.30 -0.28 6.45 1.01 -1.26 -4.36 121.20 125.07 2e9i s ILE 28 Ca -0.03 0.21 -0.10 0.00 0.00 0.00 0.00 60.65 60.73 2e9i s ILE 28 Cb -0.01 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 2e9i s ILE 28 CO 0.03 -0.61 0.16 0.00 0.00 0.00 0.00 174.94 174.52 2e9i s ASP 30 N 1.71 6.95 -0.55 0.00 1.47 -1.26 -3.56 116.67 121.43 2e9i s ASP 30 Ca 0.07 1.80 -0.09 0.00 1.18 0.00 0.00 52.55 55.51 2e9i s ASP 30 Cb -0.16 -2.55 0.14 0.00 -0.34 0.00 0.00 42.92 40.02 2e9i s ASP 30 CO 0.09 -0.71 0.42 -0.22 0.68 0.00 0.00 175.17 175.42 2e9i s LEU 31 N 3.03 5.77 -0.33 2.11 2.96 -0.37 -4.95 118.68 126.89 2e9i s LEU 31 Ca 0.57 -2.19 -0.29 0.00 -0.22 0.00 0.00 54.13 52.00 2e9i s LEU 31 Cb -0.24 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.45 2e9i s LEU 31 CO 0.19 -0.62 1.19 0.20 -1.32 0.00 0.00 176.35 175.99 2e9i s ASN 32 N 2.25 6.77 -0.14 3.68 0.01 -1.26 -2.16 114.94 124.09 2e9i s ASN 32 Ca 0.09 1.07 0.00 0.00 -0.71 0.00 0.00 52.86 53.31 2e9i s ASN 32 Cb -0.23 -2.54 -0.01 0.00 0.41 0.00 0.00 41.25 38.88 2e9i s ASN 32 CO -0.02 -1.02 -0.14 -0.76 -1.51 0.00 0.00 177.10 173.64 2e9i s LEU 33 N 4.10 2.57 -1.28 0.60 1.43 -1.03 -5.05 118.68 120.02 2e9i s LEU 33 Ca 0.51 -0.41 -0.18 0.00 -1.03 0.00 0.00 54.13 53.02 2e9i s LEU 33 Cb -0.14 -1.58 0.07 0.00 0.03 0.00 0.00 46.19 44.57 2e9i s LEU 33 CO 0.21 0.12 1.71 -0.54 0.23 0.00 0.00 176.35 178.08 2e9i s LYS 34 N 0.62 3.97 -0.12 1.70 -0.14 -1.26 -3.42 119.74 121.09 2e9i s LYS 34 Ca -0.08 -1.96 -0.06 0.00 -1.36 0.00 0.00 55.97 52.52 2e9i s LYS 34 Cb -0.16 -5.52 -0.04 0.00 -1.68 0.00 0.00 37.83 30.44 2e9i s LYS 34 CO 0.03 -2.25 0.09 0.42 -0.76 0.00 0.00 175.35 172.89 2e9i s ILE 35 N 4.22 5.10 0.00 2.17 1.01 -1.23 -5.05 121.20 127.42 2e9i s ILE 35 Ca 0.53 0.06 0.00 0.00 0.00 0.00 0.00 60.65 61.24 2e9i s ILE 35 Cb 0.04 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.29 2e9i s ILE 35 CO 0.07 0.59 0.00 -0.81 0.00 0.00 0.00 174.94 174.79 2e9i n PRO 36 N 2.24 -0.89 -0.46 2.79 -0.04 -1.26 -3.63 135.00 133.74 2e9i n PRO 36 Ca -0.19 0.00 0.41 0.00 -0.04 0.00 0.00 63.50 63.68 2e9i n PRO 36 Cb 0.54 0.00 0.63 0.00 -0.04 0.00 0.00 33.50 34.63 2e9i n PRO 36 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2e9i h GLU 37 N 0.00 0.00 -4.24 0.54 4.39 -1.92 -3.42 114.58 109.94 2e9i h GLU 37 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 2e9i h GLU 37 Cb 0.00 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 2e9i h GLU 37 CO 0.00 0.00 0.98 -0.89 -1.16 0.00 0.00 179.01 177.94 2e9i n ILE 38 N -3.58 0.00 -0.22 3.13 5.41 -1.26 -4.86 119.36 117.98 2e9i n ILE 38 Ca 0.34 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.82 2e9i n ILE 38 Cb 1.78 -0.36 0.26 0.00 -0.71 0.00 0.00 39.64 40.61 2e9i n ILE 38 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2e9i n ASN 39 N 5.58 -3.94 -0.13 4.38 4.13 -1.26 -4.98 115.26 119.03 2e9i n ASN 39 Ca 0.40 -0.77 -0.28 0.00 1.68 0.00 0.00 54.58 55.61 2e9i n ASN 39 Cb -0.02 -0.90 -0.10 0.00 -1.54 0.00 0.00 39.78 37.22 2e9i n ASN 39 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2e9i n SER 40 N -5.23 1.94 -0.06 6.41 7.64 -1.26 -3.94 113.62 119.11 2e9i n SER 40 Ca 0.12 0.36 0.24 0.00 1.01 0.00 0.00 58.87 60.60 2e9i n SER 40 Cb 0.53 -0.85 0.52 0.00 -1.01 0.00 0.00 64.21 63.40 2e9i n SER 40 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2e9i h SER 41 N -1.00 0.00 0.39 6.43 0.02 -1.99 1.25 113.55 118.66 2e9i h SER 41 Ca -0.63 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.01 2e9i h SER 41 Cb 1.55 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.07 2e9i h SER 41 CO -0.38 0.00 -1.64 0.44 -1.14 0.00 0.00 176.83 174.11 2e9i h ASP 42 N 0.00 0.35 -4.16 3.07 3.32 -1.97 -3.47 116.42 113.56 2e9i h ASP 42 Ca 0.35 -0.55 -0.45 0.00 0.02 0.00 0.00 57.03 56.40 2e9i h ASP 42 Cb 2.21 -0.11 0.15 0.00 0.22 0.00 0.00 39.33 41.80 2e9i h ASP 42 CO -0.00 1.47 0.39 -0.04 -1.72 0.00 0.00 179.24 179.34 2e9i s MET 43 N -2.60 0.87 -0.22 3.56 -1.94 0.43 -2.73 119.30 116.66 2e9i s MET 43 Ca -0.11 -0.18 -0.05 0.00 -1.71 0.00 0.00 55.69 53.64 2e9i s MET 43 Cb 0.07 -1.85 0.11 0.00 2.01 0.00 0.00 34.83 35.17 2e9i s MET 43 CO 0.83 -2.29 0.42 -1.54 -0.01 0.00 0.00 175.02 172.43 2e9i s SER 44 N -4.65 -0.13 -0.27 3.03 1.04 -0.99 -4.92 113.70 106.81 2e9i s SER 44 Ca 0.70 0.69 -0.10 0.00 0.48 0.00 0.00 55.95 57.71 2e9i s SER 44 Cb -0.07 1.32 -0.05 0.00 0.10 0.00 0.00 66.02 67.32 2e9i s SER 44 CO 0.52 -0.26 0.16 0.00 0.98 0.00 0.00 173.24 174.65 2e9i s ALA 45 N 2.60 3.48 -0.10 5.32 0.00 -1.26 -3.29 121.76 128.52 2e9i s ALA 45 Ca 0.05 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 50.92 2e9i s ALA 45 Cb -0.14 -2.38 0.05 0.00 0.00 0.00 0.00 23.12 20.65 2e9i s ALA 45 CO -0.15 -0.46 0.21 -1.01 0.00 0.00 0.00 175.76 174.35 2e9i s HIS 46 N 1.58 -0.28 -0.43 0.00 3.76 -1.17 -0.81 115.29 117.93 2e9i s HIS 46 Ca 0.07 0.72 -0.25 0.00 -0.15 0.00 0.00 55.06 55.45 2e9i s HIS 46 Cb -0.15 -0.05 0.02 0.00 1.11 0.00 0.00 32.58 33.51 2e9i s HIS 46 CO 0.09 -0.25 0.91 0.08 -0.85 0.00 0.00 174.74 174.71 2e9i s VAL 47 N 1.62 4.53 0.15 -0.90 1.01 -1.22 -1.49 120.40 124.09 2e9i s VAL 47 Ca -0.05 0.83 -0.27 0.00 0.00 0.00 0.00 61.98 62.49 2e9i s VAL 47 Cb -0.11 -4.39 -0.07 0.00 0.00 0.00 0.00 36.38 31.80 2e9i s VAL 47 CO -0.07 -0.73 0.84 -0.89 0.00 0.00 0.00 175.10 174.24 2e9i s THR 48 N 3.62 4.39 0.29 3.92 2.01 -0.17 -1.86 115.64 127.84 2e9i s THR 48 Ca 0.36 1.83 -0.06 0.00 0.31 0.00 0.00 61.69 64.13 2e9i s THR 48 Cb -0.11 -4.20 -0.06 0.00 0.01 0.00 0.00 72.50 68.14 2e9i s THR 48 CO 0.24 0.46 0.58 -0.44 -0.69 0.00 0.00 174.62 174.76 2e9i s SER 49 N -0.77 6.49 0.00 3.53 0.01 0.75 -3.31 113.70 120.39 2e9i s SER 49 Ca 0.39 0.80 0.11 0.00 1.31 0.00 0.00 55.95 58.57 2e9i s SER 49 Cb -0.23 -2.18 0.67 0.00 0.21 0.00 0.00 66.02 64.49 2e9i s SER 49 CO 0.27 -0.20 1.10 -0.81 0.41 0.00 0.00 173.24 174.02 2e9i n PRO 50 N -0.84 0.49 -0.08 12.44 -0.04 -1.24 -2.62 135.00 143.09 2e9i n PRO 50 Ca -0.01 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.34 2e9i n PRO 50 Cb 0.54 -1.36 -0.09 0.00 -0.04 0.00 0.00 33.50 32.55 2e9i n PRO 50 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2e9i n SER 51 N -0.86 2.41 0.00 3.54 3.41 -1.26 -4.99 113.62 115.86 2e9i n SER 51 Ca 0.08 -0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2e9i n SER 51 Cb 0.04 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 2e9i n SER 51 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2e9i n GLY 52 N 2.55 0.77 3.78 5.00 0.00 -1.08 -5.14 105.19 111.08 2e9i n GLY 52 Ca -0.30 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 2e9i n GLY 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2e9i s ARG 53 N 0.00 3.56 -0.04 1.61 3.00 -1.26 -4.78 118.95 121.04 2e9i s ARG 53 Ca 0.00 1.51 0.03 0.00 0.00 0.00 0.00 55.73 57.27 2e9i s ARG 53 Cb 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 34.95 32.90 2e9i s ARG 53 CO 0.00 -0.65 -0.11 0.08 0.00 0.00 0.00 175.30 174.61 2e9i s VAL 54 N -1.85 0.99 0.32 3.52 1.01 -1.26 -0.18 120.40 122.95 2e9i s VAL 54 Ca 0.70 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 62.27 2e9i s VAL 54 Cb -0.21 -0.88 0.04 0.00 0.00 0.00 0.00 36.38 35.33 2e9i s VAL 54 CO 0.24 0.30 0.33 0.35 0.00 0.00 0.00 175.10 176.33 2e9i n THR 55 N 3.40 0.00 -5.18 3.92 -2.24 -0.78 -4.98 114.28 108.43 2e9i n THR 55 Ca -0.20 -1.18 -0.30 0.00 -2.27 0.00 0.00 64.05 60.11 2e9i n THR 55 Cb 0.53 -0.45 -0.16 0.00 -2.10 0.00 0.00 70.33 68.16 2e9i n THR 55 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2e9i s GLU 56 N -3.38 2.07 0.33 -0.78 2.12 -1.26 -3.43 118.70 114.37 2e9i s GLU 56 Ca 0.25 -0.84 0.09 0.00 0.36 0.00 0.00 54.97 54.83 2e9i s GLU 56 Cb -0.02 -1.91 -0.05 0.00 0.26 0.00 0.00 34.13 32.40 2e9i s GLU 56 CO 0.16 0.46 -0.01 0.00 -0.54 0.00 0.00 175.26 175.33 2e9i s ALA 57 N -0.41 3.15 0.10 6.30 0.00 0.01 -4.85 121.76 126.06 2e9i s ALA 57 Ca 0.05 -1.93 0.06 0.00 0.00 0.00 0.00 51.96 50.14 2e9i s ALA 57 Cb -0.11 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 2e9i s ALA 57 CO 0.00 0.10 -0.05 -2.00 0.00 0.00 0.00 175.76 173.81 2e9i s GLU 58 N -3.69 2.33 -0.22 0.00 2.56 -1.25 -4.64 118.70 113.78 2e9i s GLU 58 Ca 0.34 -0.93 0.02 0.00 0.00 0.00 0.00 54.97 54.39 2e9i s GLU 58 Cb -0.01 -2.42 0.04 0.00 2.00 0.00 0.00 34.13 33.74 2e9i s GLU 58 CO 0.19 0.52 -0.15 0.42 -0.56 0.00 0.00 175.26 175.69 2e9i s ILE 59 N -1.26 2.19 -0.06 -3.70 1.01 -1.26 -2.83 121.20 115.29 2e9i s ILE 59 Ca 0.23 -1.26 -0.17 0.00 0.00 0.00 0.00 60.65 59.45 2e9i s ILE 59 Cb -0.11 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 2e9i s ILE 59 CO 0.16 0.25 0.45 -0.69 0.00 0.00 0.00 174.94 175.11 2e9i s VAL 60 N 1.21 5.10 0.09 2.92 1.01 0.65 -4.93 120.40 126.45 2e9i s VAL 60 Ca -0.02 0.91 -0.31 0.00 0.00 0.00 0.00 61.98 62.57 2e9i s VAL 60 Cb -0.16 -3.78 -0.07 0.00 0.00 0.00 0.00 36.38 32.37 2e9i s VAL 60 CO -0.09 0.44 1.38 -2.16 0.00 0.00 0.00 175.10 174.67 2e9i s PRO 61 N -0.13 4.32 0.02 2.72 0.04 -1.26 -2.28 135.00 138.43 2e9i s PRO 61 Ca 0.25 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.32 2e9i s PRO 61 Cb -0.16 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.06 2e9i s PRO 61 CO 0.12 -0.45 0.00 -1.33 0.04 0.00 0.00 177.00 175.38 2e9i n MET 62 N 4.24 0.00 -4.06 4.56 2.81 -1.25 -4.95 117.12 118.46 2e9i n MET 62 Ca 0.12 0.00 -0.19 0.00 -1.81 0.00 0.00 57.70 55.81 2e9i n MET 62 Cb 0.43 -0.08 -0.07 0.00 -0.71 0.00 0.00 33.22 32.79 2e9i n MET 62 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2e9i n GLY 63 N 3.35 3.12 0.34 3.03 0.00 -1.22 -4.95 105.19 108.85 2e9i n GLY 63 Ca 0.00 -1.95 0.11 0.00 0.00 0.00 0.00 46.02 44.18 2e9i n GLY 63 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2e9i h LYS 64 N 0.00 0.35 -0.15 1.61 2.10 -1.97 -2.76 116.57 115.74 2e9i h LYS 64 Ca -0.24 -0.02 -0.17 0.00 -2.00 0.00 0.00 60.65 58.22 2e9i h LYS 64 Cb 1.08 -0.08 -0.27 0.00 -0.90 0.00 0.00 32.23 32.07 2e9i h LYS 64 CO 0.36 0.23 -0.85 0.27 -2.00 0.00 0.00 179.45 177.46 2e9i n ASN 65 N -4.47 1.79 -4.22 7.07 6.94 -1.26 -4.05 115.26 117.06 2e9i n ASN 65 Ca 0.07 -2.84 -0.21 0.00 -0.02 0.00 0.00 54.58 51.59 2e9i n ASN 65 Cb 0.30 -0.41 -0.12 0.00 -2.36 0.00 0.00 39.78 37.19 2e9i n ASN 65 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 2e9i s SER 66 N -2.87 2.04 -0.10 0.53 0.01 -1.04 -3.52 113.70 108.74 2e9i s SER 66 Ca 0.36 -0.62 -0.16 0.00 1.31 0.00 0.00 55.95 56.84 2e9i s SER 66 Cb 0.38 -0.10 0.04 0.00 0.21 0.00 0.00 66.02 66.55 2e9i s SER 66 CO -0.09 -0.00 0.41 -1.00 0.41 0.00 0.00 173.24 172.96 2e9i s HIS 67 N -1.17 -0.39 -0.20 2.43 3.76 -1.22 -3.43 115.29 115.08 2e9i s HIS 67 Ca 0.02 0.85 -0.00 0.00 -0.15 0.00 0.00 55.06 55.78 2e9i s HIS 67 Cb -0.10 0.16 0.05 0.00 1.11 0.00 0.00 32.58 33.80 2e9i s HIS 67 CO 0.03 -0.31 -0.04 0.00 -0.85 0.00 0.00 174.74 173.57 2e9i s VAL 69 N 1.56 5.20 -0.25 0.00 1.01 -0.92 -0.25 120.40 126.75 2e9i s VAL 69 Ca -0.02 -0.64 -0.10 0.00 0.00 0.00 0.00 61.98 61.21 2e9i s VAL 69 Cb -0.17 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 2e9i s VAL 69 CO -0.07 -0.28 0.16 -0.13 0.00 0.00 0.00 175.10 174.78 2e9i s ARG 70 N 1.67 3.98 0.24 2.72 0.52 -1.13 -1.23 118.95 125.72 2e9i s ARG 70 Ca 0.05 -0.31 -0.20 0.00 -0.52 0.00 0.00 55.73 54.75 2e9i s ARG 70 Cb -0.19 -3.55 0.03 0.00 0.52 0.00 0.00 34.95 31.76 2e9i s ARG 70 CO 0.10 -0.05 0.64 -0.59 0.02 0.00 0.00 175.30 175.42 2e9i s PHE 71 N 1.35 -0.19 -0.71 -0.53 -0.12 -1.23 -3.92 117.98 112.62 2e9i s PHE 71 Ca 0.07 -0.19 -0.09 0.00 -0.05 0.00 0.00 56.93 56.67 2e9i s PHE 71 Cb -0.15 0.57 0.18 0.00 -0.63 0.00 0.00 43.02 43.00 2e9i s PHE 71 CO 0.07 -1.08 0.59 0.08 -0.05 0.00 0.00 175.22 174.83 2e9i s VAL 72 N -3.89 4.72 -1.18 -2.49 1.01 -1.26 -2.13 120.40 115.18 2e9i s VAL 72 Ca 0.10 -2.58 -0.23 0.00 0.00 0.00 0.00 61.98 59.27 2e9i s VAL 72 Cb -0.04 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.27 2e9i s VAL 72 CO 0.01 -0.94 1.93 -2.16 0.00 0.00 0.00 175.10 173.95 2e9i s PRO 73 N 0.22 2.50 -0.25 2.72 0.04 -1.26 -4.83 135.00 134.14 2e9i s PRO 73 Ca 0.16 -1.16 0.01 0.00 0.04 0.00 0.00 61.00 60.04 2e9i s PRO 73 Cb -0.16 -5.24 0.04 0.00 0.04 0.00 0.00 34.50 29.18 2e9i s PRO 73 CO -0.06 -3.98 -0.10 -1.14 0.04 0.00 0.00 177.00 171.76 2e9i s GLN 74 N 6.47 2.57 0.33 4.56 0.74 -1.26 -4.38 119.66 128.69 2e9i s GLN 74 Ca 0.68 -1.14 0.05 0.00 0.05 0.00 0.00 55.36 55.00 2e9i s GLN 74 Cb -0.01 -2.88 -0.02 0.00 1.10 0.00 0.00 33.01 31.20 2e9i s GLN 74 CO 0.13 -0.46 0.32 -1.21 -0.55 0.00 0.00 175.29 173.53 2e9i s GLU 75 N 1.22 1.78 -0.07 1.67 0.41 -1.26 -5.04 118.70 117.41 2e9i s GLU 75 Ca -0.03 -1.95 0.14 0.00 -0.41 0.00 0.00 54.97 52.72 2e9i s GLU 75 Cb -0.18 0.35 0.54 0.00 -1.78 0.00 0.00 34.13 33.06 2e9i s GLU 75 CO -0.06 -0.68 1.41 -1.33 -0.49 0.00 0.00 175.26 174.11 2e9i n MET 76 N -0.60 2.94 0.00 1.61 2.81 -1.26 -4.95 117.12 117.67 2e9i n MET 76 Ca 0.06 -2.12 0.00 0.00 -1.81 0.00 0.00 57.70 53.82 2e9i n MET 76 Cb 0.62 -1.69 0.00 0.00 -0.71 0.00 0.00 33.22 31.44 2e9i n MET 76 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2e9i n GLY 77 N 1.00 2.59 3.77 3.03 0.00 -1.26 -5.05 105.19 109.27 2e9i n GLY 77 Ca 0.19 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2e9i n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e9i s VAL 78 N 0.55 3.72 -0.10 1.61 0.11 -1.26 -4.72 120.40 120.31 2e9i s VAL 78 Ca 0.00 1.52 -0.03 0.00 -2.93 0.00 0.00 61.98 60.54 2e9i s VAL 78 Cb 0.00 -3.88 -0.03 0.00 -1.53 0.00 0.00 36.38 30.93 2e9i s VAL 78 CO 0.00 0.20 0.02 -1.00 -3.33 0.00 0.00 175.10 171.00 2e9i s HIS 79 N -1.42 3.22 -0.04 1.54 0.09 -0.87 -3.71 115.29 114.11 2e9i s HIS 79 Ca 0.50 0.22 0.00 0.00 -0.00 0.00 0.00 55.06 55.78 2e9i s HIS 79 Cb -0.26 -1.83 0.03 0.00 -0.00 0.00 0.00 32.58 30.52 2e9i s HIS 79 CO 0.33 0.47 -0.01 0.99 -0.00 0.00 0.00 174.74 176.52 2e9i s THR 80 N -0.80 0.26 -0.43 1.30 2.01 -1.21 -0.76 115.64 116.01 2e9i s THR 80 Ca 0.12 0.06 -0.18 0.00 0.31 0.00 0.00 61.69 62.00 2e9i s THR 80 Cb -0.12 -0.35 0.02 0.00 0.01 0.00 0.00 72.50 72.06 2e9i s THR 80 CO 0.02 0.17 0.50 -0.69 -0.69 0.00 0.00 174.62 173.94 2e9i s VAL 81 N 1.15 5.00 -0.59 3.82 1.01 -0.24 -0.99 120.40 129.56 2e9i s VAL 81 Ca -0.08 -0.19 -0.24 0.00 0.00 0.00 0.00 61.98 61.47 2e9i s VAL 81 Cb -0.13 -4.09 0.05 0.00 0.00 0.00 0.00 36.38 32.20 2e9i s VAL 81 CO -0.02 -0.48 0.99 -0.44 0.00 0.00 0.00 175.10 175.15 2e9i s SER 82 N 1.87 6.29 -0.31 3.32 0.01 -0.56 -1.54 113.70 122.78 2e9i s SER 82 Ca 0.16 -0.48 -0.07 0.00 1.31 0.00 0.00 55.95 56.87 2e9i s SER 82 Cb -0.16 -2.45 0.02 0.00 0.21 0.00 0.00 66.02 63.64 2e9i s SER 82 CO 0.15 -1.34 0.09 -0.69 0.41 0.00 0.00 173.24 171.86 2e9i s VAL 83 N 4.17 3.87 0.29 3.43 1.01 -1.26 -3.05 120.40 128.86 2e9i s VAL 83 Ca 0.30 -0.87 0.11 0.00 0.00 0.00 0.00 61.98 61.52 2e9i s VAL 83 Cb -0.13 -3.07 -0.05 0.00 0.00 0.00 0.00 36.38 33.13 2e9i s VAL 83 CO 0.17 -0.02 -0.16 -0.54 0.00 0.00 0.00 175.10 174.55 2e9i s LYS 84 N 1.46 1.74 -0.34 2.72 1.02 -1.21 -2.18 119.74 122.96 2e9i s LYS 84 Ca 0.01 -1.79 -0.00 0.00 0.02 0.00 0.00 55.97 54.21 2e9i s LYS 84 Cb -0.18 -1.78 0.11 0.00 -0.52 0.00 0.00 37.83 35.46 2e9i s LYS 84 CO 0.02 0.29 0.12 -0.47 -0.92 0.00 0.00 175.35 174.39 2e9i s TYR 85 N -2.52 1.83 -1.61 3.18 5.04 0.13 -2.36 117.35 121.04 2e9i s TYR 85 Ca 0.31 -1.92 -0.04 0.00 -2.44 0.00 0.00 57.07 52.98 2e9i s TYR 85 Cb -0.03 -1.79 0.00 0.00 0.35 0.00 0.00 41.96 40.49 2e9i s TYR 85 CO 0.16 -0.86 0.49 0.54 -1.34 0.00 0.00 175.55 174.53 2e9i n ARG 86 N 4.56 -4.25 -1.10 4.97 1.74 -1.11 -3.35 116.66 118.12 2e9i n ARG 86 Ca 0.01 0.94 0.00 0.00 -0.77 0.00 0.00 57.85 58.02 2e9i n ARG 86 Cb 0.40 -5.76 0.00 0.00 -1.02 0.00 0.00 32.46 26.09 2e9i n ARG 86 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2e9i n GLY 87 N -1.43 0.58 3.56 -0.13 0.00 -1.26 -5.10 105.19 101.41 2e9i n GLY 87 Ca -0.14 -0.34 -0.01 0.00 0.00 0.00 0.00 46.02 45.53 2e9i n GLY 87 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2e9i s GLN 88 N -2.12 0.37 -0.00 1.61 -2.07 -1.21 -5.13 119.66 111.10 2e9i s GLN 88 Ca 0.00 0.74 -0.30 0.00 -1.82 0.00 0.00 55.36 53.98 2e9i s GLN 88 Cb 0.00 0.25 -0.06 0.00 -1.09 0.00 0.00 33.01 32.10 2e9i s GLN 88 CO 0.00 -0.10 1.57 -1.01 -1.32 0.00 0.00 175.29 174.44 2e9i s HIS 89 N 1.82 2.38 1.24 9.60 3.76 -1.26 0.20 115.29 133.03 2e9i s HIS 89 Ca -0.07 0.42 -0.20 0.00 -0.15 0.00 0.00 55.06 55.07 2e9i s HIS 89 Cb -0.05 -3.85 0.30 0.00 1.11 0.00 0.00 32.58 30.09 2e9i s HIS 89 CO -0.16 -3.42 1.10 0.14 -0.85 0.00 0.00 174.74 171.55 2e9i s VAL 90 N 3.12 1.52 0.30 -0.90 -7.23 -0.92 -4.83 120.40 111.47 2e9i s VAL 90 Ca 0.70 0.00 -0.28 0.00 -1.81 0.00 0.00 61.98 60.59 2e9i s VAL 90 Cb -0.35 -2.46 -0.13 0.00 0.56 0.00 0.00 36.38 34.00 2e9i s VAL 90 CO 0.29 0.00 1.15 0.41 -0.31 0.00 0.00 175.10 176.64 2e9i n THR 91 N -4.89 1.90 -4.18 5.32 -1.04 -1.26 -1.67 114.28 108.46 2e9i n THR 91 Ca 0.14 -0.48 -0.35 0.00 -2.04 0.00 0.00 64.05 61.33 2e9i n THR 91 Cb 0.60 -1.25 -0.02 0.00 -1.82 0.00 0.00 70.33 67.83 2e9i n THR 91 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2e9i n GLY 92 N 1.12 -0.42 3.33 3.41 0.00 -1.26 -4.95 105.19 106.42 2e9i n GLY 92 Ca 0.08 0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 2e9i n GLY 92 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2e9i s SER 93 N -3.43 3.08 1.21 1.61 0.15 -0.67 -3.84 113.70 111.80 2e9i s SER 93 Ca 0.64 -0.54 -0.19 0.00 0.70 0.00 0.00 55.95 56.56 2e9i s SER 93 Cb -0.35 -0.30 0.29 0.00 -1.71 0.00 0.00 66.02 63.95 2e9i s SER 93 CO 0.92 0.28 1.11 -2.16 1.20 0.00 0.00 173.24 174.59 2e9i s PRO 94 N -1.00 -1.25 -0.31 5.44 0.04 -1.26 -4.77 135.00 131.89 2e9i s PRO 94 Ca 0.11 -0.08 -0.05 0.00 0.04 0.00 0.00 61.00 61.03 2e9i s PRO 94 Cb -0.10 -1.59 0.04 0.00 0.04 0.00 0.00 34.50 32.88 2e9i s PRO 94 CO 0.01 -3.73 0.05 -0.06 0.04 0.00 0.00 177.00 173.32 2e9i s PHE 95 N -3.01 3.23 0.03 0.56 0.08 -0.59 -4.95 117.98 113.33 2e9i s PHE 95 Ca 0.71 -1.53 -0.23 0.00 0.12 0.00 0.00 56.93 56.00 2e9i s PHE 95 Cb -0.10 -2.20 -0.05 0.00 -0.57 0.00 0.00 43.02 40.10 2e9i s PHE 95 CO 0.56 -0.74 0.71 -1.14 -0.10 0.00 0.00 175.22 174.51 2e9i s GLN 96 N 1.36 4.44 -0.20 0.44 0.74 -1.26 -1.07 119.66 124.10 2e9i s GLN 96 Ca -0.02 0.96 -0.19 0.00 0.05 0.00 0.00 55.36 56.16 2e9i s GLN 96 Cb -0.19 -3.36 0.05 0.00 1.10 0.00 0.00 33.01 30.62 2e9i s GLN 96 CO 0.01 0.31 0.54 -0.59 -0.55 0.00 0.00 175.29 175.01 2e9i s PHE 97 N -0.11 -0.59 0.09 1.67 -0.71 0.06 -5.01 117.98 113.38 2e9i s PHE 97 Ca 0.36 1.45 -0.10 0.00 -1.04 0.00 0.00 56.93 57.60 2e9i s PHE 97 Cb -0.20 0.20 -0.06 0.00 -1.21 0.00 0.00 43.02 41.76 2e9i s PHE 97 CO 0.21 -0.29 0.41 0.99 -1.34 0.00 0.00 175.22 175.20 2e9i s THR 98 N 0.29 5.09 0.31 -4.49 2.01 -1.26 -2.05 115.64 115.53 2e9i s THR 98 Ca -0.00 0.44 0.11 0.00 0.31 0.00 0.00 61.69 62.54 2e9i s THR 98 Cb -0.04 -3.65 -0.05 0.00 0.01 0.00 0.00 72.50 68.77 2e9i s THR 98 CO 0.01 0.26 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.40 2e9i s VAL 99 N -1.43 2.57 -0.12 3.82 1.01 -1.26 -4.52 120.40 120.47 2e9i s VAL 99 Ca 0.34 -2.22 -0.25 0.00 0.00 0.00 0.00 61.98 59.85 2e9i s VAL 99 Cb -0.14 -2.55 0.06 0.00 0.00 0.00 0.00 36.38 33.76 2e9i s VAL 99 CO 0.19 -0.31 0.61 -0.83 0.00 0.00 0.00 175.10 174.76 2e9i s GLY 100 N -3.59 -0.48 0.45 4.51 0.00 -1.12 -4.96 107.32 102.13 2e9i s GLY 100 Ca 0.32 1.36 -0.23 0.00 0.00 0.00 0.00 44.72 46.16 2e9i s GLY 100 CO 0.17 1.06 1.17 2.56 0.00 0.00 0.00 173.10 178.06 2e9i s PRO 101 N -0.63 3.80 1.26 2.90 0.04 -1.26 -3.48 135.00 137.63 2e9i s PRO 101 Ca -0.07 1.79 -0.18 0.00 0.04 0.00 0.00 61.00 62.58 2e9i s PRO 101 Cb -0.02 -2.45 0.31 0.00 0.04 0.00 0.00 34.50 32.38 2e9i s PRO 101 CO 0.06 -0.52 1.01 -0.48 0.04 0.00 0.00 177.00 177.10 2e9i s LEU 102 N -2.95 0.09 0.00 -3.56 2.34 -1.26 -4.60 118.68 108.74 2e9i s LEU 102 Ca 0.63 1.04 0.00 0.00 0.06 0.00 0.00 54.13 55.86 2e9i s LEU 102 Cb -0.29 -2.75 0.00 0.00 -0.56 0.00 0.00 46.19 42.59 2e9i s LEU 102 CO 0.35 -4.56 0.00 0.61 -1.06 0.00 0.00 176.35 171.69 2e9i n GLY 103 N 0.50 2.23 3.70 -3.48 0.00 -1.26 -5.07 105.19 101.82 2e9i n GLY 103 Ca 0.09 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 2e9i n GLY 103 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2e9i s GLU 104 N 0.00 4.29 0.00 1.61 2.12 -1.26 -4.92 118.70 120.55 2e9i s GLU 104 Ca 0.00 2.07 0.00 0.00 0.36 0.00 0.00 54.97 57.40 2e9i s GLU 104 Cb 0.00 -3.39 0.00 0.00 0.26 0.00 0.00 34.13 31.00 2e9i s GLU 104 CO 0.00 -0.52 0.00 0.41 -0.54 0.00 0.00 175.26 174.61 2e9i n GLY 105 N 3.60 3.80 0.00 -1.50 0.00 -1.26 -5.15 105.19 104.67 2e9i n GLY 105 Ca 0.12 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2e9i n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93