#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wg5 h SER 2 N 0.00 0.00 -0.89 1.61 4.64 -2.10 -3.43 113.55 113.39 1wg5 h SER 2 Ca 0.00 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.01 1wg5 h SER 2 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 1wg5 h SER 2 CO 0.00 0.45 0.80 -0.55 -0.87 0.00 0.00 176.83 176.67 1wg5 s SER 3 N -5.13 5.11 0.05 4.97 0.15 -1.26 -3.76 113.70 113.84 1wg5 s SER 3 Ca -0.03 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.12 1wg5 s SER 3 Cb 0.00 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 1wg5 s SER 3 CO 0.04 -2.73 0.00 0.61 1.20 0.00 0.00 173.24 172.36 1wg5 n GLY 4 N 6.69 -0.85 3.20 9.45 0.00 -1.26 -5.13 105.19 117.28 1wg5 n GLY 4 Ca 0.38 0.30 -0.30 0.00 0.00 0.00 0.00 46.02 46.40 1wg5 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wg5 s SER 5 N -2.00 2.77 0.13 1.61 0.01 -1.25 -5.13 113.70 109.84 1wg5 s SER 5 Ca 0.00 -0.48 0.10 0.00 1.31 0.00 0.00 55.95 56.88 1wg5 s SER 5 Cb 0.00 -1.02 -0.04 0.00 0.21 0.00 0.00 66.02 65.18 1wg5 s SER 5 CO 0.00 0.17 -0.24 -0.44 0.41 0.00 0.00 173.24 173.14 1wg5 s SER 6 N 0.16 3.05 0.17 2.44 0.01 -1.26 -5.03 113.70 113.24 1wg5 s SER 6 Ca -0.11 -0.75 -0.04 0.00 1.31 0.00 0.00 55.95 56.37 1wg5 s SER 6 Cb -0.15 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.85 1wg5 s SER 6 CO 0.05 0.12 0.17 -0.83 0.41 0.00 0.00 173.24 173.17 1wg5 s GLY 7 N -2.10 1.01 0.08 3.44 0.00 -1.26 -5.15 107.32 103.35 1wg5 s GLY 7 Ca 0.12 -1.39 -0.24 0.00 0.00 0.00 0.00 44.72 43.22 1wg5 s GLY 7 CO 0.06 -1.20 0.71 -1.31 0.00 0.00 0.00 173.10 171.36 1wg5 s ASN 8 N -3.07 7.20 0.02 1.64 -0.87 -1.26 -5.01 114.94 113.60 1wg5 s ASN 8 Ca 0.28 1.43 -0.14 0.00 -1.57 0.00 0.00 52.86 52.87 1wg5 s ASN 8 Cb 0.06 -2.44 -0.08 0.00 -0.02 0.00 0.00 41.25 38.77 1wg5 s ASN 8 CO 0.06 0.12 1.21 0.28 -2.57 0.00 0.00 177.10 176.20 1wg5 h SER 9 N 5.11 -0.42 -3.95 -1.22 0.02 -1.98 -3.44 113.55 107.67 1wg5 h SER 9 Ca -0.46 0.02 -0.51 0.00 -0.84 0.00 0.00 61.79 60.00 1wg5 h SER 9 Cb 1.21 0.11 0.06 0.00 0.14 0.00 0.00 62.40 63.91 1wg5 h SER 9 CO 0.68 -0.30 0.51 -2.16 -1.14 0.00 0.00 176.83 174.43 1wg5 s PRO 10 N -4.08 3.99 -0.17 3.45 0.04 -1.26 -4.92 135.00 132.05 1wg5 s PRO 10 Ca -0.07 1.86 -0.03 0.00 0.04 0.00 0.00 61.00 62.80 1wg5 s PRO 10 Cb 0.01 -2.64 -0.02 0.00 0.04 0.00 0.00 34.50 31.89 1wg5 s PRO 10 CO 0.22 -0.38 2.67 -3.47 0.04 0.00 0.00 177.00 176.07 1wg5 n ASP 11 N -0.02 5.81 -3.57 6.66 2.03 -1.26 -4.72 116.55 121.48 1wg5 n ASP 11 Ca 0.05 -2.75 0.02 0.00 0.52 0.00 0.00 54.79 52.63 1wg5 n ASP 11 Cb 0.46 -1.22 -0.06 0.00 -0.72 0.00 0.00 41.12 39.58 1wg5 n ASP 11 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1wg5 s THR 12 N -0.69 -0.02 -0.33 5.18 -1.32 -1.26 -5.13 115.64 112.08 1wg5 s THR 12 Ca 0.40 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.79 1wg5 s THR 12 Cb 0.23 -1.00 0.20 0.00 -1.51 0.00 0.00 72.50 70.43 1wg5 s THR 12 CO -0.05 0.00 1.10 0.00 -2.21 0.00 0.00 174.62 173.46 1wg5 s ALA 13 N 1.24 -4.61 -0.30 11.08 0.00 -1.26 -4.98 121.76 122.93 1wg5 s ALA 13 Ca -0.07 0.97 0.16 0.00 0.00 0.00 0.00 51.96 53.03 1wg5 s ALA 13 Cb -0.02 -3.02 0.48 0.00 0.00 0.00 0.00 23.12 20.56 1wg5 s ALA 13 CO -0.11 -2.53 1.09 0.09 0.00 0.00 0.00 175.76 174.30 1wg5 n ASN 14 N 3.06 2.61 -0.06 0.00 3.02 -1.26 -4.80 115.26 117.83 1wg5 n ASN 14 Ca 0.08 -2.73 -0.07 0.00 -0.03 0.00 0.00 54.58 51.84 1wg5 n ASN 14 Cb 0.65 -0.46 -0.07 0.00 -0.61 0.00 0.00 39.78 39.29 1wg5 n ASN 14 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1wg5 n ASP 15 N -0.49 2.70 -0.02 6.41 9.92 -1.26 -4.82 116.55 128.98 1wg5 n ASP 15 Ca 0.19 -0.03 0.00 0.00 -0.53 0.00 0.00 54.79 54.42 1wg5 n ASP 15 Cb 0.83 0.34 0.00 0.00 -0.64 0.00 0.00 41.12 41.65 1wg5 n ASP 15 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1wg5 n GLY 16 N 2.59 1.52 3.88 0.44 0.00 -1.26 -4.58 105.19 107.78 1wg5 n GLY 16 Ca -0.19 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 1wg5 n GLY 16 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wg5 s PHE 17 N -2.05 3.54 0.00 1.61 0.08 -1.24 -0.25 117.98 119.67 1wg5 s PHE 17 Ca 0.00 0.64 0.00 0.00 0.12 0.00 0.00 56.93 57.69 1wg5 s PHE 17 Cb 0.00 -2.05 -0.00 0.00 -0.57 0.00 0.00 43.02 40.39 1wg5 s PHE 17 CO 0.00 0.51 -0.02 0.14 -0.10 0.00 0.00 175.22 175.75 1wg5 s VAL 18 N -1.48 0.13 -0.12 -0.44 -7.23 0.11 -1.04 120.40 110.33 1wg5 s VAL 18 Ca 0.35 -0.22 -0.04 0.00 -1.81 0.00 0.00 61.98 60.27 1wg5 s VAL 18 Cb -0.13 -0.15 -0.03 0.00 0.56 0.00 0.00 36.38 36.63 1wg5 s VAL 18 CO 0.20 -0.06 0.01 -0.60 -0.31 0.00 0.00 175.10 174.35 1wg5 s ARG 19 N -0.29 3.36 0.02 4.82 3.52 -0.34 -0.95 118.95 129.08 1wg5 s ARG 19 Ca -0.02 -0.41 0.04 0.00 -0.13 0.00 0.00 55.73 55.21 1wg5 s ARG 19 Cb -0.02 -2.92 -0.03 0.00 -1.56 0.00 0.00 34.95 30.42 1wg5 s ARG 19 CO -0.00 0.51 -0.10 -0.51 -0.81 0.00 0.00 175.30 174.39 1wg5 s LEU 20 N -0.34 3.02 -0.05 -0.88 1.43 0.23 -0.28 118.68 121.80 1wg5 s LEU 20 Ca 0.07 -0.22 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 1wg5 s LEU 20 Cb -0.12 -1.74 0.03 0.00 0.03 0.00 0.00 46.19 44.38 1wg5 s LEU 20 CO 0.02 0.27 0.00 -0.13 0.23 0.00 0.00 176.35 176.75 1wg5 s ARG 21 N -1.45 0.45 0.00 1.70 0.52 0.13 -2.85 118.95 117.45 1wg5 s ARG 21 Ca 0.17 0.11 0.00 0.00 -0.52 0.00 0.00 55.73 55.48 1wg5 s ARG 21 Cb -0.11 -0.74 0.00 0.00 0.52 0.00 0.00 34.95 34.62 1wg5 s ARG 21 CO 0.07 -0.22 0.00 0.41 0.02 0.00 0.00 175.30 175.58 1wg5 n GLY 22 N 4.70 1.23 3.78 -3.53 0.00 -0.12 0.22 105.19 111.47 1wg5 n GLY 22 Ca -0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 1wg5 n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wg5 s LEU 23 N 0.00 4.09 1.06 0.99 1.43 -1.08 -4.35 118.68 120.82 1wg5 s LEU 23 Ca 0.00 2.20 -0.14 0.00 -1.03 0.00 0.00 54.13 55.16 1wg5 s LEU 23 Cb 0.00 -4.19 0.22 0.00 0.03 0.00 0.00 46.19 42.24 1wg5 s LEU 23 CO 0.00 -0.71 1.10 -2.16 0.23 0.00 0.00 176.35 174.80 1wg5 s PRO 24 N -2.57 -0.04 0.11 1.29 0.04 -1.26 -4.70 135.00 127.87 1wg5 s PRO 24 Ca 0.60 0.37 -0.31 0.00 0.04 0.00 0.00 61.00 61.70 1wg5 s PRO 24 Cb -0.26 -1.70 -0.08 0.00 0.04 0.00 0.00 34.50 32.50 1wg5 s PRO 24 CO 0.32 -3.01 1.43 0.12 0.04 0.00 0.00 177.00 175.90 1wg5 s PHE 25 N -2.97 3.15 -0.06 0.56 5.36 -1.26 -2.18 117.98 120.58 1wg5 s PHE 25 Ca 0.67 0.87 0.00 0.00 -0.96 0.00 0.00 56.93 57.50 1wg5 s PHE 25 Cb -0.17 -3.73 0.00 0.00 -0.34 0.00 0.00 43.02 38.78 1wg5 s PHE 25 CO 0.57 -2.61 0.00 0.41 -1.46 0.00 0.00 175.22 172.14 1wg5 n GLY 26 N 3.57 0.46 3.68 13.12 0.00 -1.26 -4.97 105.19 119.79 1wg5 n GLY 26 Ca 0.12 -0.16 -0.45 0.00 0.00 0.00 0.00 46.02 45.53 1wg5 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wg5 s SER 28 N 1.94 0.35 0.32 0.00 0.01 -1.26 -5.02 113.70 110.04 1wg5 s SER 28 Ca 0.82 -1.34 0.08 0.00 1.31 0.00 0.00 55.95 56.82 1wg5 s SER 28 Cb -0.61 0.48 0.81 0.00 0.21 0.00 0.00 66.02 66.91 1wg5 s SER 28 CO 0.39 -0.98 1.77 0.11 0.41 0.00 0.00 173.24 174.94 1wg5 h LYS 29 N 2.42 0.66 -1.01 12.44 1.57 -1.98 0.15 116.57 130.83 1wg5 h LYS 29 Ca -0.32 -0.04 0.23 0.00 -1.87 0.00 0.00 60.65 58.66 1wg5 h LYS 29 Cb 1.25 -0.15 -0.11 0.00 0.08 0.00 0.00 32.23 33.30 1wg5 h LYS 29 CO 0.45 0.44 0.62 0.93 -0.57 0.00 0.00 179.45 181.32 1wg5 h GLU 30 N 0.68 0.56 0.02 3.15 3.07 -1.97 0.41 114.58 120.51 1wg5 h GLU 30 Ca 0.59 -0.03 -0.27 0.00 -0.50 0.00 0.00 59.36 59.15 1wg5 h GLU 30 Cb 1.03 -0.13 -0.04 0.00 -0.84 0.00 0.00 28.75 28.78 1wg5 h GLU 30 CO -0.40 0.37 -1.46 0.93 -1.40 0.00 0.00 179.01 177.05 1wg5 h GLU 31 N 0.57 0.05 0.58 2.33 4.39 -1.15 -3.37 114.58 117.98 1wg5 h GLU 31 Ca 0.60 -0.08 -0.03 0.00 0.34 0.00 0.00 59.36 60.19 1wg5 h GLU 31 Cb 1.20 0.03 0.01 0.00 -0.10 0.00 0.00 28.75 29.89 1wg5 h GLU 31 CO -0.38 0.78 -0.28 0.82 -1.16 0.00 0.00 179.01 178.79 1wg5 h ILE 32 N 0.01 0.00 -0.72 3.13 2.04 0.32 -1.49 117.51 120.80 1wg5 h ILE 32 Ca -0.20 -0.39 0.19 0.00 1.00 0.00 0.00 64.86 65.46 1wg5 h ILE 32 Cb 1.94 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 37.88 1wg5 h ILE 32 CO 0.11 0.00 -0.03 0.52 0.00 0.00 0.00 178.15 178.75 1wg5 n VAL 33 N -5.17 -0.30 -0.01 1.67 0.31 0.12 0.18 118.33 115.14 1wg5 n VAL 33 Ca -0.10 1.60 -0.18 0.00 -0.01 0.00 0.00 64.34 65.66 1wg5 n VAL 33 Cb 0.31 -2.31 -0.09 0.00 -0.91 0.00 0.00 33.84 30.84 1wg5 n VAL 33 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1wg5 h GLN 34 N 0.00 0.67 -0.23 5.55 1.08 -1.72 -3.11 115.11 117.36 1wg5 h GLN 34 Ca 0.41 -0.60 0.07 0.00 -1.45 0.00 0.00 58.65 57.08 1wg5 h GLN 34 Cb 0.81 0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 28.37 1wg5 h GLN 34 CO -0.69 1.21 0.49 0.35 -0.95 0.00 0.00 178.83 179.24 1wg5 h PHE 35 N 0.34 0.00 -0.69 2.96 3.57 0.31 0.54 116.94 123.97 1wg5 h PHE 35 Ca -0.07 0.00 -0.41 0.00 3.53 0.00 0.00 57.97 61.02 1wg5 h PHE 35 Cb 1.41 0.00 -0.24 0.00 2.79 0.00 0.00 35.95 39.91 1wg5 h PHE 35 CO 0.10 0.00 0.16 1.19 -2.23 0.00 0.00 178.31 177.53 1wg5 n PHE 36 N -3.19 2.22 -1.45 0.41 3.72 -0.62 -5.04 117.46 113.50 1wg5 n PHE 36 Ca 0.03 -2.05 -0.44 0.00 -0.05 0.00 0.00 57.45 54.94 1wg5 n PHE 36 Cb 0.60 -0.77 -0.01 0.00 -0.94 0.00 0.00 39.48 38.36 1wg5 n PHE 36 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1wg5 n SER 37 N -1.03 -0.66 0.00 4.37 3.41 0.19 -0.65 113.62 119.25 1wg5 n SER 37 Ca 0.47 1.04 0.00 0.00 -0.26 0.00 0.00 58.87 60.12 1wg5 n SER 37 Cb 1.09 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1wg5 n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wg5 n GLY 38 N 1.77 2.94 3.91 5.00 0.00 -1.26 -5.00 105.19 112.55 1wg5 n GLY 38 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1wg5 n GLY 38 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wg5 s LEU 39 N 0.00 4.15 -0.24 0.99 1.43 0.18 -5.09 118.68 120.10 1wg5 s LEU 39 Ca 0.00 0.63 -0.04 0.00 -1.03 0.00 0.00 54.13 53.68 1wg5 s LEU 39 Cb 0.00 -3.41 -0.00 0.00 0.03 0.00 0.00 46.19 42.81 1wg5 s LEU 39 CO 0.00 -0.10 -0.01 -0.70 0.23 0.00 0.00 176.35 175.76 1wg5 s GLU 40 N -3.28 3.30 0.20 1.70 2.12 -1.26 -5.00 118.70 116.47 1wg5 s GLU 40 Ca 0.42 -0.69 0.09 0.00 0.36 0.00 0.00 54.97 55.15 1wg5 s GLU 40 Cb -0.11 -3.10 -0.04 0.00 0.26 0.00 0.00 34.13 31.14 1wg5 s GLU 40 CO 0.28 -0.26 -0.05 0.42 -0.54 0.00 0.00 175.26 175.11 1wg5 s ILE 41 N 1.48 3.40 0.39 -3.70 1.01 -1.26 -1.79 121.20 120.73 1wg5 s ILE 41 Ca 0.05 -1.65 -0.24 0.00 0.00 0.00 0.00 60.65 58.81 1wg5 s ILE 41 Cb -0.15 -2.73 -0.10 0.00 0.01 0.00 0.00 42.46 39.50 1wg5 s ILE 41 CO -0.02 -0.18 1.00 0.68 0.00 0.00 0.00 174.94 176.43 1wg5 s VAL 42 N -1.87 3.98 -0.14 2.92 -7.23 -1.12 -4.76 120.40 112.18 1wg5 s VAL 42 Ca 0.27 1.46 -0.29 0.00 -1.81 0.00 0.00 61.98 61.61 1wg5 s VAL 42 Cb -0.08 -3.72 -0.04 0.00 0.56 0.00 0.00 36.38 33.10 1wg5 s VAL 42 CO 0.17 -0.05 1.55 -2.16 -0.31 0.00 0.00 175.10 174.31 1wg5 s PRO 43 N -2.59 4.06 0.00 4.82 0.04 -1.26 -2.46 135.00 137.61 1wg5 s PRO 43 Ca 0.58 1.89 0.00 0.00 0.04 0.00 0.00 61.00 63.50 1wg5 s PRO 43 Cb -0.18 -3.95 0.00 0.00 0.04 0.00 0.00 34.50 30.40 1wg5 s PRO 43 CO 0.23 -0.97 0.00 -1.71 0.04 0.00 0.00 177.00 174.59 1wg5 n ASN 44 N 7.48 -1.81 -2.33 6.66 2.85 -1.26 -4.96 115.26 121.89 1wg5 n ASN 44 Ca 0.17 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 54.31 1wg5 n ASN 44 Cb 0.44 -0.50 0.06 0.00 1.24 0.00 0.00 39.78 41.02 1wg5 n ASN 44 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1wg5 n GLY 45 N -1.82 5.97 2.96 8.20 0.00 -1.03 -4.95 105.19 114.53 1wg5 n GLY 45 Ca 0.00 -2.43 -0.17 0.00 0.00 0.00 0.00 46.02 43.41 1wg5 n GLY 45 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wg5 s MET 46 N -3.79 0.60 -0.07 1.61 -1.94 -1.26 -0.29 119.30 114.15 1wg5 s MET 46 Ca 0.60 -0.21 0.03 0.00 -1.71 0.00 0.00 55.69 54.40 1wg5 s MET 46 Cb 0.47 -0.59 0.01 0.00 2.01 0.00 0.00 34.83 36.73 1wg5 s MET 46 CO -0.05 0.10 -0.16 0.99 -0.01 0.00 0.00 175.02 175.88 1wg5 s THR 47 N 0.06 1.44 -0.37 2.05 2.01 0.21 -4.96 115.64 116.08 1wg5 s THR 47 Ca -0.00 -0.67 0.00 0.00 0.31 0.00 0.00 61.69 61.33 1wg5 s THR 47 Cb -0.05 -1.28 0.12 0.00 0.01 0.00 0.00 72.50 71.30 1wg5 s THR 47 CO -0.00 0.42 0.18 -0.76 -0.69 0.00 0.00 174.62 173.77 1wg5 s LEU 48 N 0.45 2.12 1.13 4.42 1.02 -1.26 -0.76 118.68 125.80 1wg5 s LEU 48 Ca -0.14 -2.13 -0.17 0.00 0.02 0.00 0.00 54.13 51.72 1wg5 s LEU 48 Cb -0.16 -0.83 0.25 0.00 0.02 0.00 0.00 46.19 45.48 1wg5 s LEU 48 CO 0.05 -0.34 1.10 -2.16 0.02 0.00 0.00 176.35 175.03 1wg5 s PRO 49 N 1.02 -0.63 0.32 1.29 0.04 -1.26 -4.97 135.00 130.81 1wg5 s PRO 49 Ca 0.14 0.14 -0.04 0.00 0.04 0.00 0.00 61.00 61.29 1wg5 s PRO 49 Cb -0.21 -1.65 -0.00 0.00 0.04 0.00 0.00 34.50 32.68 1wg5 s PRO 49 CO -0.10 -3.36 0.44 0.14 0.04 0.00 0.00 177.00 174.16 1wg5 s VAL 50 N -2.99 0.00 0.00 -0.36 -7.23 -1.26 -3.22 120.40 105.33 1wg5 s VAL 50 Ca 0.69 -1.61 0.00 0.00 -1.81 0.00 0.00 61.98 59.25 1wg5 s VAL 50 Cb -0.13 -2.56 0.00 0.00 0.56 0.00 0.00 36.38 34.25 1wg5 s VAL 50 CO 0.57 0.00 0.00 -0.67 -0.31 0.00 0.00 175.10 174.69 1wg5 n ASP 51 N -1.16 0.00 0.00 4.85 2.03 -0.99 -4.84 116.55 116.45 1wg5 n ASP 51 Ca 0.01 -0.11 0.13 0.00 0.52 0.00 0.00 54.79 55.34 1wg5 n ASP 51 Cb 0.62 0.00 0.61 0.00 -0.72 0.00 0.00 41.12 41.63 1wg5 n ASP 51 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1wg5 n PHE 52 N -0.17 0.00 0.60 -0.67 7.35 -1.26 -2.87 117.46 120.44 1wg5 n PHE 52 Ca 0.00 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.76 1wg5 n PHE 52 Cb 0.00 -0.45 -0.01 0.00 0.35 0.00 0.00 39.48 39.37 1wg5 n PHE 52 CO 0.00 0.00 0.00 1.04 -0.76 0.00 0.00 176.76 177.04 1wg5 n GLN 53 N -1.45 2.01 -0.85 -4.13 6.02 -1.26 -4.98 117.38 112.74 1wg5 n GLN 53 Ca 0.08 -0.59 0.00 0.00 -0.01 0.00 0.00 57.00 56.48 1wg5 n GLN 53 Cb 0.29 -1.18 0.00 0.00 1.02 0.00 0.00 30.24 30.37 1wg5 n GLN 53 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1wg5 n GLY 54 N 1.09 0.67 3.68 1.08 0.00 -1.14 -5.05 105.19 105.52 1wg5 n GLY 54 Ca 0.05 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.00 1wg5 n GLY 54 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1wg5 s ARG 55 N -1.79 4.14 0.05 1.61 1.70 -1.26 -4.78 118.95 118.62 1wg5 s ARG 55 Ca 0.00 -0.06 -0.28 0.00 -0.47 0.00 0.00 55.73 54.91 1wg5 s ARG 55 Cb 0.00 -3.51 -0.15 0.00 -0.57 0.00 0.00 34.95 30.72 1wg5 s ARG 55 CO 0.00 0.08 0.70 -1.13 -1.08 0.00 0.00 175.30 173.87 1wg5 n SER 56 N 4.16 -0.34 -1.21 -2.89 3.41 -1.26 -2.33 113.62 113.16 1wg5 n SER 56 Ca -0.13 0.91 0.03 0.00 -0.26 0.00 0.00 58.87 59.42 1wg5 n SER 56 Cb 0.52 -0.73 0.19 0.00 -0.26 0.00 0.00 64.21 63.93 1wg5 n SER 56 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1wg5 n THR 57 N 0.79 1.40 -1.38 6.66 -2.24 -1.20 -4.80 114.28 113.51 1wg5 n THR 57 Ca 0.15 -0.70 -0.14 0.00 -2.27 0.00 0.00 64.05 61.09 1wg5 n THR 57 Cb 0.11 -0.41 -0.06 0.00 -2.10 0.00 0.00 70.33 67.86 1wg5 n THR 57 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wg5 n GLY 58 N 0.27 1.34 3.17 3.38 0.00 -1.26 -4.91 105.19 107.18 1wg5 n GLY 58 Ca 0.15 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.00 1wg5 n GLY 58 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wg5 s GLU 59 N -3.13 0.81 0.07 1.61 2.02 -1.26 -0.95 118.70 117.87 1wg5 s GLU 59 Ca 0.00 -1.00 -0.26 0.00 0.02 0.00 0.00 54.97 53.72 1wg5 s GLU 59 Cb 0.00 -0.70 0.07 0.00 0.10 0.00 0.00 34.13 33.60 1wg5 s GLU 59 CO 0.00 0.14 0.63 0.00 0.02 0.00 0.00 175.26 176.06 1wg5 s ALA 60 N -1.64 -1.67 -0.13 5.21 0.00 -1.13 -4.20 121.76 118.19 1wg5 s ALA 60 Ca -0.00 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.79 1wg5 s ALA 60 Cb -0.08 0.53 0.02 0.00 0.00 0.00 0.00 23.12 23.59 1wg5 s ALA 60 CO 0.02 -0.61 -0.12 -0.06 0.00 0.00 0.00 175.76 174.99 1wg5 s PHE 61 N -2.71 1.95 -0.06 0.00 0.08 0.06 -0.60 117.98 116.71 1wg5 s PHE 61 Ca -0.04 -1.06 0.01 0.00 0.12 0.00 0.00 56.93 55.97 1wg5 s PHE 61 Cb -0.01 -1.47 -0.03 0.00 -0.57 0.00 0.00 43.02 40.94 1wg5 s PHE 61 CO -0.04 -0.61 -0.08 0.08 -0.10 0.00 0.00 175.22 174.48 1wg5 s VAL 62 N 1.51 3.62 -0.33 -0.44 1.01 -0.12 -0.62 120.40 125.02 1wg5 s VAL 62 Ca 0.04 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.50 1wg5 s VAL 62 Cb -0.13 -2.48 0.09 0.00 0.00 0.00 0.00 36.38 33.86 1wg5 s VAL 62 CO -0.09 0.58 0.04 -1.58 0.00 0.00 0.00 175.10 174.05 1wg5 s GLN 63 N -0.86 1.86 1.16 2.72 0.74 0.60 0.09 119.66 125.97 1wg5 s GLN 63 Ca 0.13 -1.68 -0.16 0.00 0.05 0.00 0.00 55.36 53.69 1wg5 s GLN 63 Cb -0.11 -3.22 0.27 0.00 1.10 0.00 0.00 33.01 31.05 1wg5 s GLN 63 CO 0.02 -0.85 1.07 -0.06 -0.55 0.00 0.00 175.29 174.91 1wg5 s PHE 64 N 1.03 1.00 0.38 1.67 0.08 0.65 -2.81 117.98 119.99 1wg5 s PHE 64 Ca 0.04 0.76 0.07 0.00 0.12 0.00 0.00 56.93 57.92 1wg5 s PHE 64 Cb -0.20 -3.27 0.77 0.00 -0.57 0.00 0.00 43.02 39.75 1wg5 s PHE 64 CO -0.06 -3.73 1.96 0.00 -0.10 0.00 0.00 175.22 173.29 1wg5 h ALA 65 N -2.49 1.54 -2.55 5.36 0.00 -1.65 -3.40 119.26 116.07 1wg5 h ALA 65 Ca -0.51 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.23 1wg5 h ALA 65 Cb 1.32 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1wg5 h ALA 65 CO 0.44 0.34 0.05 -1.13 0.00 0.00 0.00 179.25 178.94 1wg5 n SER 66 N -4.35 -0.64 0.19 0.00 3.41 -1.26 -4.99 113.62 105.98 1wg5 n SER 66 Ca 0.01 -1.54 0.10 0.00 -0.26 0.00 0.00 58.87 57.18 1wg5 n SER 66 Cb 0.19 1.10 0.13 0.00 -0.26 0.00 0.00 64.21 65.36 1wg5 n SER 66 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1wg5 h GLN 67 N 0.00 0.00 -0.00 4.33 4.15 -1.88 -3.06 115.11 118.65 1wg5 h GLN 67 Ca -0.10 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.15 1wg5 h GLN 67 Cb 0.39 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.06 1wg5 h GLN 67 CO 0.13 0.12 -0.78 1.05 -1.93 0.00 0.00 178.83 177.41 1wg5 h GLU 68 N 0.00 0.01 0.00 1.69 4.11 -1.98 -3.02 114.58 115.38 1wg5 h GLU 68 Ca -0.00 -0.01 -0.22 0.00 0.07 0.00 0.00 59.36 59.20 1wg5 h GLU 68 Cb 1.09 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 1wg5 h GLU 68 CO 0.02 0.79 -1.13 0.82 0.07 0.00 0.00 179.01 179.57 1wg5 h ILE 69 N 0.00 1.55 -0.23 -1.06 2.04 -1.94 -3.31 117.51 114.57 1wg5 h ILE 69 Ca -0.01 -3.29 -0.04 0.00 1.00 0.00 0.00 64.86 62.53 1wg5 h ILE 69 Cb 1.39 2.77 -0.01 0.00 -0.74 0.00 0.00 36.82 40.22 1wg5 h ILE 69 CO 0.10 0.88 -0.01 0.00 0.00 0.00 0.00 178.15 179.13 1wg5 h ALA 70 N 1.00 0.31 -0.89 1.87 0.00 -1.53 -3.00 119.26 117.01 1wg5 h ALA 70 Ca -0.06 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 54.75 1wg5 h ALA 70 Cb 1.81 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.44 1wg5 h ALA 70 CO 0.12 0.04 0.52 0.93 0.00 0.00 0.00 179.25 180.86 1wg5 h GLU 71 N 0.17 0.78 -0.55 0.00 5.08 -1.64 0.58 114.58 118.99 1wg5 h GLU 71 Ca 0.06 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1wg5 h GLU 71 Cb 0.42 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1wg5 h GLU 71 CO 0.01 0.52 0.33 0.87 -1.00 0.00 0.00 179.01 179.74 1wg5 h LYS 72 N 0.80 0.74 0.00 2.33 1.57 -1.62 -1.91 116.57 118.49 1wg5 h LYS 72 Ca 0.45 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 59.01 1wg5 h LYS 72 Cb 0.51 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 1wg5 h LYS 72 CO -0.29 0.53 -0.77 0.00 -0.57 0.00 0.00 179.45 178.35 1wg5 h ALA 73 N 1.60 0.58 -0.96 3.86 0.00 -0.86 -3.26 119.26 120.22 1wg5 h ALA 73 Ca 0.20 -0.70 0.14 0.00 0.00 0.00 0.00 54.91 54.55 1wg5 h ALA 73 Cb -0.02 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.56 1wg5 h ALA 73 CO -0.04 0.96 0.61 -0.07 0.00 0.00 0.00 179.25 180.71 1wg5 h LEU 74 N 0.00 0.81 -1.11 0.00 3.38 -0.14 0.39 115.31 118.65 1wg5 h LEU 74 Ca -0.01 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1wg5 h LEU 74 Cb 1.50 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1wg5 h LEU 74 CO 0.10 0.41 0.00 0.29 0.09 0.00 0.00 178.44 179.33 1wg5 n LYS 75 N -4.61 0.13 -0.74 1.13 4.76 -1.20 -2.24 118.16 115.38 1wg5 n LYS 75 Ca 0.19 0.58 -0.14 0.00 -2.87 0.00 0.00 58.31 56.07 1wg5 n LYS 75 Cb 0.42 -1.88 0.05 0.00 -1.84 0.00 0.00 35.03 31.78 1wg5 n LYS 75 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1wg5 n LYS 76 N -2.15 1.67 -2.04 1.97 5.02 0.14 -4.94 118.16 117.83 1wg5 n LYS 76 Ca -0.01 -1.39 -0.32 0.00 -2.02 0.00 0.00 58.31 54.58 1wg5 n LYS 76 Cb 0.07 -1.54 0.01 0.00 -0.02 0.00 0.00 35.03 33.54 1wg5 n LYS 76 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1wg5 s HIS 77 N -1.58 3.20 -0.35 2.13 2.46 -0.95 -3.28 115.29 116.91 1wg5 s HIS 77 Ca 0.27 1.46 0.00 0.00 0.47 0.00 0.00 55.06 57.26 1wg5 s HIS 77 Cb 0.22 -2.90 0.00 0.00 -0.13 0.00 0.00 32.58 29.77 1wg5 s HIS 77 CO 0.01 -0.89 0.00 1.63 -2.47 0.00 0.00 174.74 173.02 1wg5 n LYS 78 N -2.17 -1.90 -2.29 2.88 4.76 0.41 -4.89 118.16 114.97 1wg5 n LYS 78 Ca 0.08 0.57 -0.43 0.00 -2.87 0.00 0.00 58.31 55.66 1wg5 n LYS 78 Cb 0.53 -4.90 -0.02 0.00 -1.84 0.00 0.00 35.03 28.80 1wg5 n LYS 78 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1wg5 s GLU 79 N -2.13 3.76 0.37 1.97 0.41 -0.93 -4.02 118.70 118.14 1wg5 s GLU 79 Ca 0.00 1.30 -0.24 0.00 -0.41 0.00 0.00 54.97 55.63 1wg5 s GLU 79 Cb 0.00 -3.98 -0.10 0.00 -1.78 0.00 0.00 34.13 28.27 1wg5 s GLU 79 CO 0.00 -1.33 0.94 -0.98 -0.49 0.00 0.00 175.26 173.40 1wg5 s ARG 80 N 4.60 4.41 -0.54 1.61 1.04 -1.26 -1.41 118.95 127.41 1wg5 s ARG 80 Ca 0.63 1.22 0.04 0.00 -1.04 0.00 0.00 55.73 56.58 1wg5 s ARG 80 Cb -0.19 -2.52 0.14 0.00 -2.04 0.00 0.00 34.95 30.34 1wg5 s ARG 80 CO 0.28 0.14 0.29 0.42 -0.04 0.00 0.00 175.30 176.39 1wg5 s ILE 81 N -1.88 2.54 0.00 4.99 1.01 -0.84 -4.84 121.20 122.18 1wg5 s ILE 81 Ca 0.55 -3.41 0.00 0.00 0.00 0.00 0.00 60.65 57.79 1wg5 s ILE 81 Cb -0.14 -2.75 0.00 0.00 0.01 0.00 0.00 42.46 39.58 1wg5 s ILE 81 CO 0.19 -0.84 0.00 0.61 0.00 0.00 0.00 174.94 174.90 1wg5 n GLY 82 N 2.96 2.49 1.80 6.18 0.00 -1.26 -4.24 105.19 113.12 1wg5 n GLY 82 Ca 0.08 -0.53 -0.01 0.00 0.00 0.00 0.00 46.02 45.56 1wg5 n GLY 82 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1wg5 n HIS 83 N 0.00 -0.16 -3.15 1.61 1.44 -1.26 -5.12 115.22 108.57 1wg5 n HIS 83 Ca 0.00 -0.22 0.04 0.00 -2.01 0.00 0.00 57.72 55.53 1wg5 n HIS 83 Cb 0.00 0.73 -0.01 0.00 0.12 0.00 0.00 29.99 30.83 1wg5 n HIS 83 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 1wg5 s ARG 84 N 0.01 0.51 0.37 -1.40 1.81 -1.26 -5.03 118.95 113.95 1wg5 s ARG 84 Ca 0.01 0.90 -0.28 0.00 -1.72 0.00 0.00 55.73 54.64 1wg5 s ARG 84 Cb 0.03 0.50 -0.11 0.00 -0.45 0.00 0.00 34.95 34.92 1wg5 s ARG 84 CO -0.01 -0.55 1.41 0.66 -0.68 0.00 0.00 175.30 176.13 1wg5 n TYR 85 N 5.44 2.72 -4.67 -0.53 4.01 -1.26 -1.99 117.16 120.88 1wg5 n TYR 85 Ca -0.02 0.49 -0.33 0.00 -0.16 0.00 0.00 57.90 57.87 1wg5 n TYR 85 Cb 0.51 -2.49 -0.13 0.00 -0.31 0.00 0.00 39.34 36.93 1wg5 n TYR 85 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1wg5 s ILE 86 N -1.11 3.44 -0.34 -0.72 -1.09 -0.50 -4.49 121.20 116.39 1wg5 s ILE 86 Ca 0.54 -0.55 -0.08 0.00 -2.23 0.00 0.00 60.65 58.34 1wg5 s ILE 86 Cb -0.51 -2.43 0.03 0.00 -1.58 0.00 0.00 42.46 37.97 1wg5 s ILE 86 CO 0.63 0.55 0.12 -1.61 -1.23 0.00 0.00 174.94 173.41 1wg5 s GLU 87 N -0.20 2.77 -0.13 2.79 2.02 0.13 0.16 118.70 126.24 1wg5 s GLU 87 Ca 0.02 -1.09 -0.11 0.00 0.02 0.00 0.00 54.97 53.81 1wg5 s GLU 87 Cb -0.13 -3.50 -0.05 0.00 0.10 0.00 0.00 34.13 30.55 1wg5 s GLU 87 CO 0.03 -0.63 0.22 0.42 0.02 0.00 0.00 175.26 175.33 1wg5 s ILE 88 N 1.46 5.35 -0.05 -1.63 1.01 -1.26 0.20 121.20 126.28 1wg5 s ILE 88 Ca 0.00 0.40 -0.02 0.00 0.00 0.00 0.00 60.65 61.03 1wg5 s ILE 88 Cb -0.19 -3.53 0.03 0.00 0.01 0.00 0.00 42.46 38.78 1wg5 s ILE 88 CO 0.04 0.52 0.07 -0.36 0.00 0.00 0.00 174.94 175.21 1wg5 s PHE 89 N -0.37 0.02 0.02 3.97 0.08 0.62 -4.91 117.98 117.41 1wg5 s PHE 89 Ca 0.16 0.31 -0.39 0.00 0.12 0.00 0.00 56.93 57.13 1wg5 s PHE 89 Cb -0.13 -0.43 -0.18 0.00 -0.57 0.00 0.00 43.02 41.71 1wg5 s PHE 89 CO 0.04 -0.20 1.23 1.17 -0.10 0.00 0.00 175.22 177.37 1wg5 n LYS 90 N 5.23 0.59 -2.34 0.44 0.00 -1.26 -1.20 118.16 119.61 1wg5 n LYS 90 Ca -0.05 0.21 -0.03 0.00 0.00 0.00 0.00 58.31 58.44 1wg5 n LYS 90 Cb 0.50 -1.79 -0.01 0.00 0.00 0.00 0.00 35.03 33.73 1wg5 n LYS 90 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1wg5 n SER 91 N 2.15 0.27 -4.16 3.14 2.88 -0.21 -4.78 113.62 112.91 1wg5 n SER 91 Ca 0.20 -1.33 -0.10 0.00 -1.33 0.00 0.00 58.87 56.31 1wg5 n SER 91 Cb 0.13 0.22 -0.10 0.00 -0.75 0.00 0.00 64.21 63.71 1wg5 n SER 91 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wg5 s SER 92 N -1.36 0.59 0.09 -3.46 0.15 -1.26 -3.70 113.70 104.76 1wg5 s SER 92 Ca 0.05 -1.15 -0.29 0.00 0.70 0.00 0.00 55.95 55.26 1wg5 s SER 92 Cb 0.00 0.23 -0.13 0.00 -1.71 0.00 0.00 66.02 64.41 1wg5 s SER 92 CO 0.04 -0.65 1.64 -0.09 1.20 0.00 0.00 173.24 175.37 1wg5 h ARG 93 N 2.89 -0.57 -0.84 5.44 2.43 -1.94 -2.38 114.38 119.40 1wg5 h ARG 93 Ca -0.35 0.04 0.09 0.00 -0.81 0.00 0.00 59.98 58.94 1wg5 h ARG 93 Cb 1.19 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 30.80 1wg5 h ARG 93 CO 0.62 -0.38 0.50 0.00 -1.51 0.00 0.00 179.97 179.19 1wg5 h ALA 94 N 0.02 1.20 -0.46 2.80 0.00 -1.97 -2.12 119.26 118.72 1wg5 h ALA 94 Ca -0.02 0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1wg5 h ALA 94 Cb 0.52 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 1wg5 h ALA 94 CO -0.02 0.15 0.04 0.93 0.00 0.00 0.00 179.25 180.35 1wg5 h GLU 95 N 0.85 0.16 -4.86 0.00 4.39 -1.88 -3.41 114.58 109.82 1wg5 h GLU 95 Ca 0.40 -0.01 -0.53 0.00 0.34 0.00 0.00 59.36 59.55 1wg5 h GLU 95 Cb 0.32 -0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.86 1wg5 h GLU 95 CO -0.23 0.10 1.49 0.28 -1.16 0.00 0.00 179.01 179.49 1wg5 n VAL 96 N -5.17 0.00 -0.90 3.13 0.31 -0.80 -4.44 118.33 110.47 1wg5 n VAL 96 Ca 0.04 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.49 1wg5 n VAL 96 Cb 0.24 -0.46 -0.03 0.00 -0.91 0.00 0.00 33.84 32.68 1wg5 n VAL 96 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1wg5 n ARG 97 N 7.50 -1.71 0.00 5.55 5.12 -1.26 -4.93 116.66 126.93 1wg5 n ARG 97 Ca 0.57 1.18 0.00 0.00 -1.93 0.00 0.00 57.85 57.67 1wg5 n ARG 97 Cb 0.01 -2.14 0.00 0.00 -1.16 0.00 0.00 32.46 29.17 1wg5 n ARG 97 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1wg5 n THR 98 N -2.85 0.00 -1.33 0.55 -2.24 -1.26 -4.99 114.28 102.16 1wg5 n THR 98 Ca -0.00 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.38 1wg5 n THR 98 Cb 0.60 -0.01 0.02 0.00 -2.10 0.00 0.00 70.33 68.83 1wg5 n THR 98 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1wg5 n SER 99 N -1.07 -2.60 -4.80 3.42 7.64 -1.26 -4.90 113.62 110.05 1wg5 n SER 99 Ca 0.00 0.72 -0.35 0.00 1.01 0.00 0.00 58.87 60.26 1wg5 n SER 99 Cb 0.01 -0.96 -0.06 0.00 -1.01 0.00 0.00 64.21 62.19 1wg5 n SER 99 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wg5 s GLY 100 N -1.04 2.58 0.17 0.23 0.00 -1.24 -4.94 107.32 103.07 1wg5 s GLY 100 Ca 0.61 0.51 0.20 0.00 0.00 0.00 0.00 44.72 46.04 1wg5 s GLY 100 CO 0.62 0.86 1.62 -1.55 0.00 0.00 0.00 173.10 174.65 1wg5 n PRO 101 N -0.24 0.13 -0.08 2.90 -0.04 -1.26 -3.62 135.00 132.79 1wg5 n PRO 101 Ca 0.05 0.37 -0.09 0.00 -0.04 0.00 0.00 63.50 63.79 1wg5 n PRO 101 Cb 0.52 -1.74 -0.03 0.00 -0.04 0.00 0.00 33.50 32.21 1wg5 n PRO 101 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wg5 n SER 102 N -1.98 1.87 -4.59 3.54 2.88 -1.26 -4.93 113.62 109.15 1wg5 n SER 102 Ca 0.03 0.49 -0.35 0.00 -1.33 0.00 0.00 58.87 57.71 1wg5 n SER 102 Cb 0.21 -0.83 -0.10 0.00 -0.75 0.00 0.00 64.21 62.74 1wg5 n SER 102 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wg5 s SER 103 N -5.96 5.51 0.00 -3.46 0.01 -1.24 -5.29 113.70 103.28 1wg5 s SER 103 Ca -0.22 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.06 1wg5 s SER 103 Cb 0.04 -1.95 0.00 0.00 0.21 0.00 0.00 66.02 64.32 1wg5 s SER 103 CO 0.34 0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.73