#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wg2 s SER 2 N 0.00 2.36 -0.14 1.61 0.01 -1.26 -5.11 113.70 111.17 1wg2 s SER 2 Ca 0.00 -1.19 -0.29 0.00 1.31 0.00 0.00 55.95 55.78 1wg2 s SER 2 Cb 0.00 -0.09 -0.02 0.00 0.21 0.00 0.00 66.02 66.12 1wg2 s SER 2 CO 0.00 -0.40 1.30 -0.94 0.41 0.00 0.00 173.24 173.61 1wg2 s SER 3 N -3.37 6.93 0.00 2.44 1.04 -1.26 -4.71 113.70 114.76 1wg2 s SER 3 Ca 0.28 1.76 0.00 0.00 0.48 0.00 0.00 55.95 58.47 1wg2 s SER 3 Cb 0.04 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1wg2 s SER 3 CO 0.10 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.17 1wg2 n GLY 4 N 3.64 1.90 3.41 7.32 0.00 -1.26 -5.09 105.19 115.11 1wg2 n GLY 4 Ca 0.14 -0.50 -0.44 0.00 0.00 0.00 0.00 46.02 45.22 1wg2 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wg2 s SER 5 N 0.00 6.16 -0.27 1.61 1.04 -1.26 -5.05 113.70 115.93 1wg2 s SER 5 Ca 0.00 -1.18 -0.09 0.00 0.48 0.00 0.00 55.95 55.16 1wg2 s SER 5 Cb 0.00 -2.20 -0.03 0.00 0.10 0.00 0.00 66.02 63.89 1wg2 s SER 5 CO 0.00 -0.66 0.12 -0.44 0.98 0.00 0.00 173.24 173.25 1wg2 s SER 6 N 2.46 5.48 -0.20 7.02 0.01 -1.26 -5.08 113.70 122.14 1wg2 s SER 6 Ca 0.06 -0.21 -0.05 0.00 1.31 0.00 0.00 55.95 57.07 1wg2 s SER 6 Cb -0.22 -2.00 -0.02 0.00 0.21 0.00 0.00 66.02 63.98 1wg2 s SER 6 CO 0.08 -0.07 -0.01 -0.83 0.41 0.00 0.00 173.24 172.82 1wg2 s GLY 7 N 1.66 1.70 -0.68 3.44 0.00 -1.26 -5.05 107.32 107.13 1wg2 s GLY 7 Ca 0.06 -0.99 -0.26 0.00 0.00 0.00 0.00 44.72 43.53 1wg2 s GLY 7 CO 0.06 0.22 1.88 2.56 0.00 0.00 0.00 173.10 177.82 1wg2 s PRO 8 N 0.98 2.61 -0.02 2.90 0.04 -1.26 -4.96 135.00 135.29 1wg2 s PRO 8 Ca 0.01 0.41 0.06 0.00 0.04 0.00 0.00 61.00 61.51 1wg2 s PRO 8 Cb -0.14 -4.54 -0.03 0.00 0.04 0.00 0.00 34.50 29.83 1wg2 s PRO 8 CO 0.01 -2.88 -0.18 -1.54 0.04 0.00 0.00 177.00 172.46 1wg2 s SER 9 N 8.09 3.73 0.47 6.66 1.04 -1.26 -5.10 113.70 127.32 1wg2 s SER 9 Ca 0.68 -0.32 -0.25 0.00 0.48 0.00 0.00 55.95 56.54 1wg2 s SER 9 Cb -0.11 -0.66 -0.08 0.00 0.10 0.00 0.00 66.02 65.26 1wg2 s SER 9 CO 0.16 0.32 1.37 0.54 0.98 0.00 0.00 173.24 176.61 1wg2 n ARG 10 N 2.16 2.04 0.00 4.02 1.74 -1.26 -5.01 116.66 120.35 1wg2 n ARG 10 Ca -0.17 0.73 0.00 0.00 -0.77 0.00 0.00 57.85 57.65 1wg2 n ARG 10 Cb 0.52 -2.55 0.00 0.00 -1.02 0.00 0.00 32.46 29.40 1wg2 n ARG 10 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1wg2 n PRO 11 N -0.31 0.24 -0.94 5.56 -0.04 -1.26 -4.84 135.00 133.41 1wg2 n PRO 11 Ca 0.07 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.40 1wg2 n PRO 11 Cb 0.42 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.81 1wg2 n PRO 11 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1wg2 n VAL 12 N -1.26 2.74 -3.22 0.52 0.24 -1.26 -4.86 118.33 111.23 1wg2 n VAL 12 Ca 0.00 -1.53 -0.43 0.00 -2.04 0.00 0.00 64.34 60.33 1wg2 n VAL 12 Cb 0.00 -1.67 -0.07 0.00 -1.47 0.00 0.00 33.84 30.63 1wg2 n VAL 12 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1wg2 s ARG 13 N -0.30 3.14 0.05 7.34 1.81 -1.26 -5.04 118.95 124.69 1wg2 s ARG 13 Ca 0.40 -0.75 -0.31 0.00 -1.72 0.00 0.00 55.73 53.36 1wg2 s ARG 13 Cb 0.23 -4.02 -0.07 0.00 -0.45 0.00 0.00 34.95 30.65 1wg2 s ARG 13 CO -0.04 -1.02 1.41 -1.25 -0.68 0.00 0.00 175.30 173.72 1wg2 s PRO 14 N 2.42 4.29 0.07 3.54 0.04 -1.26 -4.92 135.00 139.19 1wg2 s PRO 14 Ca 0.15 2.03 0.18 0.00 0.04 0.00 0.00 61.00 63.39 1wg2 s PRO 14 Cb -0.17 -3.46 -0.13 0.00 0.04 0.00 0.00 34.50 30.78 1wg2 s PRO 14 CO 0.14 -0.53 0.82 0.09 0.04 0.00 0.00 177.00 177.56 1wg2 n ASN 15 N 4.88 0.82 -4.52 6.66 3.02 -1.26 -4.74 115.26 120.12 1wg2 n ASN 15 Ca 0.13 0.36 -0.13 0.00 -0.03 0.00 0.00 54.58 54.90 1wg2 n ASN 15 Cb 0.43 0.25 -0.10 0.00 -0.61 0.00 0.00 39.78 39.75 1wg2 n ASN 15 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1wg2 n ASN 16 N -2.85 1.05 -3.58 6.41 0.23 -1.26 -4.74 115.26 110.52 1wg2 n ASN 16 Ca -0.09 -2.22 -0.07 0.00 -0.53 0.00 0.00 54.58 51.67 1wg2 n ASN 16 Cb 0.81 -1.61 -0.02 0.00 -2.08 0.00 0.00 39.78 36.88 1wg2 n ASN 16 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1wg2 s ARG 17 N 8.29 1.01 -0.06 -3.83 0.52 -1.26 -2.19 118.95 121.42 1wg2 s ARG 17 Ca 0.77 -0.45 -0.16 0.00 -0.52 0.00 0.00 55.73 55.37 1wg2 s ARG 17 Cb -0.07 0.41 -0.05 0.00 0.52 0.00 0.00 34.95 35.76 1wg2 s ARG 17 CO 0.16 -0.45 0.43 0.00 0.02 0.00 0.00 175.30 175.46 1wg2 n PHE 19 N 2.79 0.37 0.00 0.00 7.35 0.18 -0.18 117.46 127.97 1wg2 n PHE 19 Ca -0.11 -0.30 0.00 0.00 -0.76 0.00 0.00 57.45 56.28 1wg2 n PHE 19 Cb 0.52 -0.23 0.00 0.00 0.35 0.00 0.00 39.48 40.12 1wg2 n PHE 19 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1wg2 n SER 20 N 0.14 0.79 0.00 -2.13 7.64 -1.26 -4.88 113.62 113.92 1wg2 n SER 20 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1wg2 n SER 20 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 1wg2 n SER 20 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wg2 n ASN 22 N -0.45 -5.03 -4.59 0.00 4.13 0.74 -4.91 115.26 105.16 1wg2 n ASN 22 Ca 0.00 0.20 -0.43 0.00 1.68 0.00 0.00 54.58 56.03 1wg2 n ASN 22 Cb 0.00 -4.07 -0.03 0.00 -1.54 0.00 0.00 39.78 34.14 1wg2 n ASN 22 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1wg2 s LYS 23 N -4.15 3.68 -0.47 3.52 2.20 -1.26 -4.42 119.74 118.84 1wg2 s LYS 23 Ca 0.00 0.46 -0.43 0.00 -0.36 0.00 0.00 55.97 55.64 1wg2 s LYS 23 Cb 0.00 -3.91 -0.18 0.00 -1.51 0.00 0.00 37.83 32.23 1wg2 s LYS 23 CO 0.00 -1.33 2.05 0.36 -0.36 0.00 0.00 175.35 176.06 1wg2 n LYS 24 N 7.65 0.19 -0.87 4.03 2.85 -1.26 -1.76 118.16 128.98 1wg2 n LYS 24 Ca 0.10 0.06 0.01 0.00 -1.05 0.00 0.00 58.31 57.43 1wg2 n LYS 24 Cb 0.49 -1.65 0.33 0.00 -0.65 0.00 0.00 35.03 33.55 1wg2 n LYS 24 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 1wg2 n VAL 25 N 6.12 2.60 0.00 0.58 0.24 -0.93 -4.78 118.33 122.16 1wg2 n VAL 25 Ca 0.48 -1.36 0.00 0.00 -2.04 0.00 0.00 64.34 61.43 1wg2 n VAL 25 Cb -0.00 -0.34 0.00 0.00 -1.47 0.00 0.00 33.84 32.02 1wg2 n VAL 25 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wg2 n GLY 26 N 0.27 0.93 1.86 7.63 0.00 -1.25 -1.24 105.19 113.39 1wg2 n GLY 26 Ca 0.31 -0.19 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 1wg2 n GLY 26 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1wg2 n VAL 27 N 0.00 2.62 -2.17 1.61 0.24 -1.26 -4.17 118.33 115.20 1wg2 n VAL 27 Ca 0.00 -1.40 -0.03 0.00 -2.04 0.00 0.00 64.34 60.88 1wg2 n VAL 27 Cb 0.00 -0.39 0.09 0.00 -1.47 0.00 0.00 33.84 32.06 1wg2 n VAL 27 CO 0.00 0.00 0.00 1.15 -2.14 0.00 0.00 176.83 175.84 1wg2 n MET 28 N 0.01 1.70 -2.49 7.34 0.00 -0.37 -5.08 117.12 118.23 1wg2 n MET 28 Ca 0.35 -3.22 -0.24 0.00 0.00 0.00 0.00 57.70 54.58 1wg2 n MET 28 Cb 1.25 -1.36 0.04 0.00 0.00 0.00 0.00 33.22 33.15 1wg2 n MET 28 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1wg2 s GLY 29 N -3.12 1.68 -0.44 3.17 0.00 -0.90 -4.89 107.32 102.82 1wg2 s GLY 29 Ca 0.38 -0.98 -0.09 0.00 0.00 0.00 0.00 44.72 44.02 1wg2 s GLY 29 CO -0.06 -0.68 0.29 -1.36 0.00 0.00 0.00 173.10 171.29 1wg2 s PHE 30 N -2.94 3.37 -0.15 1.90 0.40 0.16 -4.90 117.98 115.81 1wg2 s PHE 30 Ca 0.56 -1.64 -0.27 0.00 -0.60 0.00 0.00 56.93 54.97 1wg2 s PHE 30 Cb -0.10 -3.16 -0.01 0.00 0.51 0.00 0.00 43.02 40.25 1wg2 s PHE 30 CO 0.42 -0.90 0.92 0.21 0.70 0.00 0.00 175.22 176.57 1wg2 s LYS 31 N 1.41 4.34 0.51 0.44 2.20 -1.26 -2.03 119.74 125.35 1wg2 s LYS 31 Ca 0.04 1.20 -0.11 0.00 -0.36 0.00 0.00 55.97 56.74 1wg2 s LYS 31 Cb -0.24 -3.57 -0.05 0.00 -1.51 0.00 0.00 37.83 32.46 1wg2 s LYS 31 CO 0.01 -0.35 0.90 0.00 -0.36 0.00 0.00 175.35 175.54 1wg2 h LYS 33 N 0.51 0.26 -0.62 0.00 1.57 -1.95 0.18 116.57 116.52 1wg2 h LYS 33 Ca -0.46 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.28 1wg2 h LYS 33 Cb 1.19 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.41 1wg2 h LYS 33 CO 0.62 0.17 0.30 0.00 -0.57 0.00 0.00 179.45 179.98 1wg2 n GLY 35 N -1.17 1.99 3.49 0.00 0.00 0.61 -5.09 105.19 105.02 1wg2 n GLY 35 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1wg2 n GLY 35 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wg2 s SER 36 N -2.00 3.90 -0.10 1.61 0.01 -1.25 -4.91 113.70 110.97 1wg2 s SER 36 Ca 0.00 -0.54 -0.06 0.00 1.31 0.00 0.00 55.95 56.66 1wg2 s SER 36 Cb 0.00 -0.57 -0.04 0.00 0.21 0.00 0.00 66.02 65.62 1wg2 s SER 36 CO 0.00 0.19 0.15 -0.89 0.41 0.00 0.00 173.24 173.10 1wg2 s THR 37 N -1.12 5.48 0.14 1.44 2.01 -1.26 -0.73 115.64 121.61 1wg2 s THR 37 Ca 0.18 0.17 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 1wg2 s THR 37 Cb -0.11 -3.43 -0.04 0.00 0.01 0.00 0.00 72.50 68.93 1wg2 s THR 37 CO 0.10 0.57 0.07 -0.36 -0.69 0.00 0.00 174.62 174.30 1wg2 s PHE 38 N -1.08 0.92 -0.46 4.92 0.08 -0.86 0.51 117.98 122.01 1wg2 s PHE 38 Ca 0.17 -1.26 0.01 0.00 0.12 0.00 0.00 56.93 55.97 1wg2 s PHE 38 Cb -0.12 -0.50 0.47 0.00 -0.57 0.00 0.00 43.02 42.30 1wg2 s PHE 38 CO 0.07 -0.54 1.89 0.00 -0.10 0.00 0.00 175.22 176.54 1wg2 n GLY 40 N -0.71 0.99 0.23 0.00 0.00 -1.26 -4.55 105.19 99.89 1wg2 n GLY 40 Ca 0.51 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.65 1wg2 n GLY 40 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1wg2 h SER 41 N 0.00 0.00 0.00 1.61 0.02 -2.00 -3.06 113.55 110.12 1wg2 h SER 41 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1wg2 h SER 41 Cb 0.00 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 1wg2 h SER 41 CO 0.00 0.15 -0.27 1.41 -1.14 0.00 0.00 176.83 176.98 1wg2 n HIS 42 N -3.24 0.00 0.32 3.45 -0.00 -1.26 -4.69 115.22 109.80 1wg2 n HIS 42 Ca 0.01 -0.98 0.14 0.00 -0.00 0.00 0.00 57.72 56.89 1wg2 n HIS 42 Cb 0.44 -0.16 0.42 0.00 -0.00 0.00 0.00 29.99 30.69 1wg2 n HIS 42 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.34 176.41 1wg2 h ARG 43 N 0.34 0.00 -7.14 -0.41 0.11 -1.85 -3.42 114.38 102.02 1wg2 h ARG 43 Ca -0.02 0.00 -0.48 0.00 0.10 0.00 0.00 59.98 59.58 1wg2 h ARG 43 Cb 1.11 0.00 0.05 0.00 1.11 0.00 0.00 29.97 32.24 1wg2 h ARG 43 CO 0.01 0.00 0.38 0.71 0.10 0.00 0.00 179.97 181.17 1wg2 s TYR 44 N -3.36 2.97 0.06 4.08 1.51 -1.26 -4.78 117.35 116.57 1wg2 s TYR 44 Ca 0.05 1.54 -0.18 0.00 -1.01 0.00 0.00 57.07 57.47 1wg2 s TYR 44 Cb 0.08 -3.05 -0.12 0.00 -0.11 0.00 0.00 41.96 38.76 1wg2 s TYR 44 CO 0.58 -1.03 1.37 -1.00 -1.11 0.00 0.00 175.55 174.37 1wg2 h PRO 45 N 0.97 0.49 0.00 -1.71 0.13 -1.94 -2.95 132.00 126.99 1wg2 h PRO 45 Ca -0.48 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.39 1wg2 h PRO 45 Cb 1.22 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1wg2 h PRO 45 CO 0.58 0.84 0.00 1.05 -0.23 0.00 0.00 178.00 180.24 1wg2 h GLU 46 N 0.16 0.00 0.13 0.86 4.11 -1.94 0.30 114.58 118.20 1wg2 h GLU 46 Ca 0.03 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 59.19 1wg2 h GLU 46 Cb 0.75 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.00 1wg2 h GLU 46 CO 0.05 0.00 -1.23 0.87 0.07 0.00 0.00 179.01 178.77 1wg2 h LYS 47 N 0.00 0.30 -0.44 1.06 1.79 -1.86 -3.32 116.57 114.10 1wg2 h LYS 47 Ca 0.00 -0.49 -0.31 0.00 -2.18 0.00 0.00 60.65 57.67 1wg2 h LYS 47 Cb 0.14 0.18 -0.23 0.00 -1.58 0.00 0.00 32.23 30.73 1wg2 h LYS 47 CO 0.00 1.23 -0.57 -2.39 -1.08 0.00 0.00 179.45 176.63 1wg2 n HIS 48 N -3.56 1.58 -3.64 -1.35 1.44 -0.67 -4.97 115.22 104.05 1wg2 n HIS 48 Ca -0.09 -1.92 -0.20 0.00 -2.01 0.00 0.00 57.72 53.50 1wg2 n HIS 48 Cb 1.01 -0.36 -0.03 0.00 0.12 0.00 0.00 29.99 30.73 1wg2 n HIS 48 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1wg2 n GLU 49 N -0.91 -0.84 -0.89 -1.40 -0.58 0.64 -4.79 120.64 111.86 1wg2 n GLU 49 Ca 0.34 -0.03 -0.33 0.00 -0.42 0.00 0.00 57.16 56.72 1wg2 n GLU 49 Cb 0.86 -1.66 0.12 0.00 -0.57 0.00 0.00 31.44 30.20 1wg2 n GLU 49 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wg2 n SER 51 N -2.12 1.62 -4.54 0.00 7.64 -1.26 -4.94 113.62 110.02 1wg2 n SER 51 Ca 0.09 -2.88 -0.43 0.00 1.01 0.00 0.00 58.87 56.67 1wg2 n SER 51 Cb 0.52 -0.41 -0.04 0.00 -1.01 0.00 0.00 64.21 63.28 1wg2 n SER 51 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1wg2 s PHE 52 N -1.87 2.77 -0.84 1.43 2.19 -1.26 -4.94 117.98 115.47 1wg2 s PHE 52 Ca 0.36 0.16 -0.21 0.00 0.33 0.00 0.00 56.93 57.58 1wg2 s PHE 52 Cb 0.38 -4.16 -0.20 0.00 -1.31 0.00 0.00 43.02 37.73 1wg2 s PHE 52 CO -0.10 -1.36 2.27 -0.25 1.83 0.00 0.00 175.22 177.61 1wg2 n ASP 53 N 7.63 0.75 -0.03 6.13 8.00 -1.26 -4.73 116.55 133.04 1wg2 n ASP 53 Ca 0.04 -1.31 -0.13 0.00 0.71 0.00 0.00 54.79 54.10 1wg2 n ASP 53 Cb 0.48 -1.33 -0.09 0.00 -0.02 0.00 0.00 41.12 40.17 1wg2 n ASP 53 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1wg2 h PHE 54 N 12.03 0.22 -2.21 1.24 0.04 -2.02 -3.45 116.94 122.79 1wg2 h PHE 54 Ca 0.01 -0.07 -0.43 0.00 2.80 0.00 0.00 57.97 60.28 1wg2 h PHE 54 Cb 1.04 -0.05 0.04 0.00 2.20 0.00 0.00 35.95 39.18 1wg2 h PHE 54 CO 1.23 0.64 -0.11 0.15 -0.60 0.00 0.00 178.31 179.62 1wg2 s LYS 55 N -4.20 2.65 -0.24 1.51 -0.14 -1.26 -5.12 119.74 112.94 1wg2 s LYS 55 Ca -0.15 -0.90 -0.05 0.00 -1.36 0.00 0.00 55.97 53.51 1wg2 s LYS 55 Cb 0.03 -2.57 0.12 0.00 -1.68 0.00 0.00 37.83 33.73 1wg2 s LYS 55 CO 0.72 -0.56 0.44 -2.00 -0.76 0.00 0.00 175.35 173.19 1wg2 s GLU 56 N -4.63 0.39 -0.02 1.68 2.56 -1.26 -5.15 118.70 112.26 1wg2 s GLU 56 Ca 0.56 0.87 -0.09 0.00 0.00 0.00 0.00 54.97 56.30 1wg2 s GLU 56 Cb -0.10 0.08 -0.05 0.00 2.00 0.00 0.00 34.13 36.06 1wg2 s GLU 56 CO 0.37 -0.45 0.29 0.54 -0.56 0.00 0.00 175.26 175.44 1wg2 s VAL 57 N 2.64 5.26 0.15 3.70 0.11 -1.26 -5.07 120.40 125.93 1wg2 s VAL 57 Ca 0.07 0.39 -0.23 0.00 -2.93 0.00 0.00 61.98 59.28 1wg2 s VAL 57 Cb -0.14 -3.57 0.08 0.00 -1.53 0.00 0.00 36.38 31.22 1wg2 s VAL 57 CO -0.16 0.48 1.09 -0.83 -3.33 0.00 0.00 175.10 172.35 1wg2 s GLY 58 N -1.36 0.09 -0.28 6.54 0.00 -1.26 -5.10 107.32 105.94 1wg2 s GLY 58 Ca 0.24 -0.29 -0.28 0.00 0.00 0.00 0.00 44.72 44.38 1wg2 s GLY 58 CO 0.12 3.18 2.11 -0.45 0.00 0.00 0.00 173.10 178.06 1wg2 s SER 59 N -3.51 5.49 -0.16 1.64 0.15 -1.26 -4.88 113.70 111.18 1wg2 s SER 59 Ca 0.24 1.64 -0.34 0.00 0.70 0.00 0.00 55.95 58.18 1wg2 s SER 59 Cb -0.02 -2.51 0.14 0.00 -1.71 0.00 0.00 66.02 61.91 1wg2 s SER 59 CO 0.04 -1.97 1.28 -0.83 1.20 0.00 0.00 173.24 172.96 1wg2 s GLY 60 N 7.98 -0.32 -1.03 9.45 0.00 -1.26 -5.08 107.32 117.06 1wg2 s GLY 60 Ca 0.94 1.38 -0.24 0.00 0.00 0.00 0.00 44.72 46.80 1wg2 s GLY 60 CO 0.34 0.42 1.94 2.56 0.00 0.00 0.00 173.10 178.36 1wg2 s PRO 61 N -2.32 2.53 -0.61 2.90 0.04 -1.26 -4.84 135.00 131.43 1wg2 s PRO 61 Ca 0.11 -0.69 0.05 0.00 0.04 0.00 0.00 61.00 60.51 1wg2 s PRO 61 Cb 0.01 -5.15 0.17 0.00 0.04 0.00 0.00 34.50 29.57 1wg2 s PRO 61 CO -0.04 -3.66 0.44 0.45 0.04 0.00 0.00 177.00 174.23 1wg2 s SER 62 N 7.33 3.88 -0.04 6.66 0.15 -1.26 -5.06 113.70 125.36 1wg2 s SER 62 Ca 0.69 -3.59 -0.30 0.00 0.70 0.00 0.00 55.95 53.45 1wg2 s SER 62 Cb -0.04 -1.30 0.11 0.00 -1.71 0.00 0.00 66.02 63.08 1wg2 s SER 62 CO 0.06 -0.12 1.06 -0.55 1.20 0.00 0.00 173.24 174.89 1wg2 s SER 63 N -0.97 -0.22 0.00 5.45 0.15 -1.26 -5.21 113.70 111.65 1wg2 s SER 63 Ca 0.26 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.82 1wg2 s SER 63 Cb -0.04 0.29 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 1wg2 s SER 63 CO -0.16 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.38