#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 -0.40 -0.26 1.61 1.04 -1.26 -5.18 113.70 109.26 1wg2 s SER 2 Ca 0.00 -0.18 -0.19 0.00 0.48 0.00 0.00 55.95 56.06 1wg2 s SER 2 Cb 0.00 0.55 0.07 0.00 0.10 0.00 0.00 66.02 66.75 1wg2 s SER 2 CO 0.00 -0.94 0.66 -0.55 0.98 0.00 0.00 173.24 173.39 1wg2 s SER 3 N -2.74 -0.80 -0.19 7.02 0.15 -1.26 -5.16 113.70 110.72 1wg2 s SER 3 Ca 0.06 1.40 -0.08 0.00 0.70 0.00 0.00 55.95 58.03 1wg2 s SER 3 Cb -0.02 1.34 0.08 0.00 -1.71 0.00 0.00 66.02 65.71 1wg2 s SER 3 CO -0.06 -0.23 0.42 -0.83 1.20 0.00 0.00 173.24 173.73 1wg2 s GLY 4 N 1.01 -0.35 -0.14 9.45 0.00 -1.26 -5.15 107.32 110.88 1wg2 s GLY 4 Ca -0.05 1.51 -0.09 0.00 0.00 0.00 0.00 44.72 46.08 1wg2 s GLY 4 CO -0.10 2.21 0.35 -1.35 0.00 0.00 0.00 173.10 174.22 1wg2 s SER 5 N 2.28 -0.40 0.21 1.64 1.04 -1.26 -5.17 113.70 112.04 1wg2 s SER 5 Ca -0.04 0.74 -0.15 0.00 0.48 0.00 0.00 55.95 56.98 1wg2 s SER 5 Cb -0.11 0.67 0.01 0.00 0.10 0.00 0.00 66.02 66.69 1wg2 s SER 5 CO -0.13 -0.16 0.47 -0.94 0.98 0.00 0.00 173.24 173.47 1wg2 s SER 6 N 0.91 -0.15 0.00 7.02 1.04 -1.26 -5.07 113.70 116.19 1wg2 s SER 6 Ca -0.06 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.69 1wg2 s SER 6 Cb -0.07 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1wg2 s SER 6 CO -0.07 -1.06 0.00 0.61 0.98 0.00 0.00 173.24 173.70 1wg2 n GLY 7 N -0.33 0.76 3.56 7.32 0.00 -1.26 -4.99 105.19 110.25 1wg2 n GLY 7 Ca -0.07 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 1wg2 n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wg2 s PRO 8 N -1.45 2.57 0.12 1.61 0.04 -1.26 -4.96 135.00 131.67 1wg2 s PRO 8 Ca 0.00 -0.04 0.04 0.00 0.04 0.00 0.00 61.00 61.03 1wg2 s PRO 8 Cb 0.00 -4.88 -0.04 0.00 0.04 0.00 0.00 34.50 29.62 1wg2 s PRO 8 CO 0.00 -3.20 0.13 -1.12 0.04 0.00 0.00 177.00 172.84 1wg2 s SER 9 N 8.06 5.63 -0.04 6.66 0.01 -1.26 -5.12 113.70 127.64 1wg2 s SER 9 Ca 0.69 -0.03 0.02 0.00 1.31 0.00 0.00 55.95 57.94 1wg2 s SER 9 Cb -0.08 -1.52 0.01 0.00 0.21 0.00 0.00 66.02 64.63 1wg2 s SER 9 CO 0.05 0.12 -0.08 -0.13 0.41 0.00 0.00 173.24 173.61 1wg2 s ARG 10 N -2.75 1.02 0.00 12.44 0.52 -1.26 -5.15 118.95 123.77 1wg2 s ARG 10 Ca 0.31 -0.27 0.00 0.00 -0.52 0.00 0.00 55.73 55.25 1wg2 s ARG 10 Cb -0.11 -0.95 0.00 0.00 0.52 0.00 0.00 34.95 34.41 1wg2 s ARG 10 CO 0.23 0.05 0.00 -0.35 0.02 0.00 0.00 175.30 175.26 1wg2 n PRO 11 N 3.55 -0.26 -0.46 3.54 -0.04 -1.26 -4.86 135.00 135.21 1wg2 n PRO 11 Ca -0.21 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.19 1wg2 n PRO 11 Cb 0.53 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.02 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 -1.76 1.90 0.24 0.52 0.24 -1.26 -4.37 118.33 113.85 1wg2 n VAL 12 Ca 0.00 -0.70 -0.10 0.00 -2.04 0.00 0.00 64.34 61.49 1wg2 n VAL 12 Cb 0.00 -1.16 -0.05 0.00 -1.47 0.00 0.00 33.84 31.16 1wg2 n VAL 12 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1wg2 h ARG 13 N 0.70 -0.65 -6.33 7.34 2.47 -2.04 -3.43 114.38 112.44 1wg2 h ARG 13 Ca 0.13 0.04 -0.55 0.00 -1.26 0.00 0.00 59.98 58.35 1wg2 h ARG 13 Cb 1.18 0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 29.64 1wg2 h ARG 13 CO 0.28 -0.43 0.92 -1.25 0.56 0.00 0.00 179.97 180.05 1wg2 s PRO 14 N -3.77 4.24 -0.04 0.04 0.04 -1.26 -4.88 135.00 129.38 1wg2 s PRO 14 Ca -0.10 2.02 0.05 0.00 0.04 0.00 0.00 61.00 63.01 1wg2 s PRO 14 Cb 0.01 -3.70 -0.07 0.00 0.04 0.00 0.00 34.50 30.78 1wg2 s PRO 14 CO 0.30 -0.67 0.05 0.27 0.04 0.00 0.00 177.00 176.99 1wg2 n ASN 15 N 5.98 3.70 -4.48 6.66 6.94 -1.26 -4.91 115.26 127.88 1wg2 n ASN 15 Ca 0.14 0.00 -0.13 0.00 -0.02 0.00 0.00 54.58 54.58 1wg2 n ASN 15 Cb 0.43 0.83 -0.10 0.00 -2.36 0.00 0.00 39.78 38.58 1wg2 n ASN 15 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 1wg2 n ASN 16 N -2.04 0.62 -3.62 0.53 0.23 -1.26 -4.73 115.26 104.99 1wg2 n ASN 16 Ca -0.06 -1.74 -0.08 0.00 -0.53 0.00 0.00 54.58 52.17 1wg2 n ASN 16 Cb 0.51 -1.39 -0.06 0.00 -2.08 0.00 0.00 39.78 36.76 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 7.95 0.40 0.17 -3.83 0.52 -1.26 -2.87 118.95 120.03 1wg2 s ARG 17 Ca 0.80 0.25 -0.30 0.00 -0.52 0.00 0.00 55.73 55.96 1wg2 s ARG 17 Cb -0.17 0.19 -0.07 0.00 0.52 0.00 0.00 34.95 35.41 1wg2 s ARG 17 CO 0.17 -0.09 1.02 0.00 0.02 0.00 0.00 175.30 176.42 1wg2 n PHE 19 N 2.28 0.47 0.00 0.00 7.35 0.30 -0.25 117.46 127.61 1wg2 n PHE 19 Ca 0.01 -0.35 0.00 0.00 -0.76 0.00 0.00 57.45 56.36 1wg2 n PHE 19 Cb 0.47 -0.25 0.00 0.00 0.35 0.00 0.00 39.48 40.05 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 0.95 0.00 -2.13 7.64 -1.26 -4.88 113.62 114.08 1wg2 n SER 20 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1wg2 n SER 20 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 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 -0.37 -4.88 -4.57 0.00 4.13 0.66 -4.91 115.26 105.32 1wg2 n ASN 22 Ca 0.00 0.19 -0.42 0.00 1.68 0.00 0.00 54.58 56.03 1wg2 n ASN 22 Cb 0.02 -3.90 -0.03 0.00 -1.54 0.00 0.00 39.78 34.33 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 -4.08 3.50 -0.42 3.52 2.20 -1.26 -4.39 119.74 118.82 1wg2 s LYS 23 Ca 0.00 0.20 -0.39 0.00 -0.36 0.00 0.00 55.97 55.42 1wg2 s LYS 23 Cb 0.00 -4.01 -0.17 0.00 -1.51 0.00 0.00 37.83 32.14 1wg2 s LYS 23 CO 0.00 -1.64 1.37 0.36 -0.36 0.00 0.00 175.35 175.08 1wg2 n LYS 24 N 8.28 0.00 -0.96 4.03 2.85 -1.26 -1.98 118.16 129.13 1wg2 n LYS 24 Ca 0.08 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.23 1wg2 n LYS 24 Cb 0.49 -1.25 0.22 0.00 -0.65 0.00 0.00 35.03 33.83 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 3.50 2.83 0.00 0.58 0.24 -1.14 -4.77 118.33 119.57 1wg2 n VAL 25 Ca 0.27 -2.20 0.00 0.00 -2.04 0.00 0.00 64.34 60.37 1wg2 n VAL 25 Cb -0.05 -0.37 0.00 0.00 -1.47 0.00 0.00 33.84 31.95 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 -0.92 0.71 2.16 7.63 0.00 -1.26 -2.05 105.19 111.45 1wg2 n GLY 26 Ca 0.43 -0.28 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 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 3.11 -2.32 1.61 0.24 -1.26 -4.21 118.33 115.51 1wg2 n VAL 27 Ca 0.00 -1.81 0.03 0.00 -2.04 0.00 0.00 64.34 60.52 1wg2 n VAL 27 Cb 0.00 -0.43 0.06 0.00 -1.47 0.00 0.00 33.84 32.00 1wg2 n VAL 27 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 1wg2 n MET 28 N -0.78 0.63 -2.00 7.34 2.81 -0.87 -5.10 117.12 119.15 1wg2 n MET 28 Ca 0.53 -2.50 -0.29 0.00 -1.81 0.00 0.00 57.70 53.63 1wg2 n MET 28 Cb 1.58 -0.58 0.18 0.00 -0.71 0.00 0.00 33.22 33.68 1wg2 n MET 28 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1wg2 s GLY 29 N -2.50 1.78 -0.43 3.03 0.00 -0.87 -4.97 107.32 103.37 1wg2 s GLY 29 Ca 0.35 -1.25 -0.06 0.00 0.00 0.00 0.00 44.72 43.76 1wg2 s GLY 29 CO -0.13 -0.50 0.25 -1.36 0.00 0.00 0.00 173.10 171.36 1wg2 s PHE 30 N -3.81 3.46 -0.16 1.90 0.08 -0.21 -4.93 117.98 114.32 1wg2 s PHE 30 Ca 0.73 -2.02 -0.27 0.00 0.12 0.00 0.00 56.93 55.49 1wg2 s PHE 30 Cb -0.04 -3.20 -0.01 0.00 -0.57 0.00 0.00 43.02 39.20 1wg2 s PHE 30 CO 0.52 -0.95 0.91 0.21 -0.10 0.00 0.00 175.22 175.81 1wg2 s LYS 31 N 1.28 4.33 0.60 0.44 2.20 -1.26 -2.25 119.74 125.07 1wg2 s LYS 31 Ca 0.06 1.17 -0.08 0.00 -0.36 0.00 0.00 55.97 56.75 1wg2 s LYS 31 Cb -0.24 -3.57 -0.02 0.00 -1.51 0.00 0.00 37.83 32.49 1wg2 s LYS 31 CO -0.02 -0.36 0.95 0.00 -0.36 0.00 0.00 175.35 175.56 1wg2 h LYS 33 N -0.22 0.00 -0.40 0.00 1.57 -1.95 -0.32 116.57 115.25 1wg2 h LYS 33 Ca -0.45 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.25 1wg2 h LYS 33 Cb 1.22 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.51 1wg2 h LYS 33 CO 0.62 0.00 -0.07 0.00 -0.57 0.00 0.00 179.45 179.43 1wg2 n GLY 35 N -0.59 1.85 3.47 0.00 0.00 -0.13 -5.05 105.19 104.74 1wg2 n GLY 35 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 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 3.76 -0.13 1.61 0.01 -1.25 -4.92 113.70 110.78 1wg2 s SER 36 Ca 0.00 -0.61 -0.09 0.00 1.31 0.00 0.00 55.95 56.57 1wg2 s SER 36 Cb 0.00 -0.47 -0.04 0.00 0.21 0.00 0.00 66.02 65.71 1wg2 s SER 36 CO 0.00 0.18 0.18 -0.89 0.41 0.00 0.00 173.24 173.11 1wg2 s THR 37 N -1.14 5.43 0.12 1.44 2.01 -1.26 -1.40 115.64 120.83 1wg2 s THR 37 Ca 0.17 0.29 0.01 0.00 0.31 0.00 0.00 61.69 62.47 1wg2 s THR 37 Cb -0.10 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 1wg2 s THR 37 CO 0.09 0.56 -0.01 -0.36 -0.69 0.00 0.00 174.62 174.22 1wg2 s PHE 38 N -0.64 0.93 -0.43 4.92 0.08 -0.95 0.11 117.98 121.99 1wg2 s PHE 38 Ca 0.14 -1.06 0.00 0.00 0.12 0.00 0.00 56.93 56.14 1wg2 s PHE 38 Cb -0.12 -0.54 0.39 0.00 -0.57 0.00 0.00 43.02 42.17 1wg2 s PHE 38 CO 0.04 -0.30 1.89 0.00 -0.10 0.00 0.00 175.22 176.75 1wg2 n GLY 40 N -0.43 1.22 0.23 0.00 0.00 -1.26 -4.52 105.19 100.42 1wg2 n GLY 40 Ca 0.45 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.57 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 -0.02 1.61 0.02 -2.00 -2.73 113.55 110.42 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 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1wg2 h SER 41 CO 0.00 0.22 -0.23 1.41 -1.14 0.00 0.00 176.83 177.09 1wg2 n HIS 42 N -3.54 0.08 0.37 3.45 -0.00 -1.26 -4.65 115.22 109.67 1wg2 n HIS 42 Ca -0.01 -1.25 0.14 0.00 -0.00 0.00 0.00 57.72 56.61 1wg2 n HIS 42 Cb 0.37 -0.21 0.47 0.00 -0.00 0.00 0.00 29.99 30.62 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 0.55 0.00 -7.05 -0.41 0.11 -1.80 -3.45 114.38 102.33 1wg2 h ARG 43 Ca 0.01 0.00 -0.47 0.00 0.10 0.00 0.00 59.98 59.62 1wg2 h ARG 43 Cb 1.04 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.14 1wg2 h ARG 43 CO 0.02 0.00 0.39 0.71 0.10 0.00 0.00 179.97 181.19 1wg2 s TYR 44 N -3.36 3.07 0.22 4.08 1.51 -1.26 -4.79 117.35 116.81 1wg2 s TYR 44 Ca 0.05 1.59 -0.01 0.00 -1.01 0.00 0.00 57.07 57.69 1wg2 s TYR 44 Cb 0.09 -3.06 0.21 0.00 -0.11 0.00 0.00 41.96 39.08 1wg2 s TYR 44 CO 0.54 -0.74 1.58 -1.00 -1.11 0.00 0.00 175.55 174.82 1wg2 h PRO 45 N 1.76 0.54 0.00 -1.71 0.13 -1.87 -2.84 132.00 128.02 1wg2 h PRO 45 Ca -0.49 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.35 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 0.60 0.87 0.00 1.05 -0.23 0.00 0.00 178.00 180.29 1wg2 h GLU 46 N 0.44 0.00 -0.63 0.86 4.11 -1.96 -1.70 114.58 115.70 1wg2 h GLU 46 Ca 0.03 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.42 1wg2 h GLU 46 Cb 0.93 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 1wg2 h GLU 46 CO 0.08 0.00 0.06 1.63 0.07 0.00 0.00 179.01 180.85 1wg2 n LYS 47 N -3.06 4.59 -3.50 1.06 4.76 -1.07 -4.86 118.16 116.09 1wg2 n LYS 47 Ca -0.01 -3.08 0.01 0.00 -2.87 0.00 0.00 58.31 52.37 1wg2 n LYS 47 Cb 0.21 -2.25 -0.05 0.00 -1.84 0.00 0.00 35.03 31.10 1wg2 n LYS 47 CO 0.00 0.00 0.00 -3.38 -1.37 0.00 0.00 177.40 172.65 1wg2 s HIS 48 N -2.78 -0.36 -0.96 2.13 -3.43 -0.64 -4.87 115.29 104.38 1wg2 s HIS 48 Ca 0.54 0.67 -0.14 0.00 -0.80 0.00 0.00 55.06 55.33 1wg2 s HIS 48 Cb 0.41 0.21 -0.30 0.00 -1.43 0.00 0.00 32.58 31.48 1wg2 s HIS 48 CO 0.15 -0.18 2.24 -0.85 -2.00 0.00 0.00 174.74 174.11 1wg2 n GLU 49 N 4.00 0.09 -3.48 -0.38 0.28 -1.26 -4.70 120.64 115.19 1wg2 n GLU 49 Ca -0.14 -0.11 -0.43 0.00 -0.16 0.00 0.00 57.16 56.33 1wg2 n GLU 49 Cb 0.56 -1.44 -0.09 0.00 1.43 0.00 0.00 31.44 31.90 1wg2 n GLU 49 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1wg2 n SER 51 N 5.10 6.03 -4.77 0.00 7.64 -1.26 -4.93 113.62 121.44 1wg2 n SER 51 Ca -0.12 -3.38 -0.36 0.00 1.01 0.00 0.00 58.87 56.02 1wg2 n SER 51 Cb 0.45 -0.94 -0.07 0.00 -1.01 0.00 0.00 64.21 62.64 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 -2.77 3.50 -1.10 1.43 2.19 -1.26 -5.02 117.98 114.95 1wg2 s PHE 52 Ca 0.47 0.52 -0.22 0.00 0.33 0.00 0.00 56.93 58.04 1wg2 s PHE 52 Cb 0.38 -2.19 0.03 0.00 -1.31 0.00 0.00 43.02 39.93 1wg2 s PHE 52 CO 0.02 0.40 1.64 0.34 1.83 0.00 0.00 175.22 179.45 1wg2 s ASP 53 N -0.02 6.30 0.05 6.13 2.15 -1.26 -4.80 116.67 125.22 1wg2 s ASP 53 Ca 0.14 -1.67 -0.22 0.00 0.43 0.00 0.00 52.55 51.24 1wg2 s ASP 53 Cb -0.12 -2.57 -0.14 0.00 -0.30 0.00 0.00 42.92 39.79 1wg2 s ASP 53 CO 0.03 -1.71 1.45 -0.26 -0.17 0.00 0.00 175.17 174.51 1wg2 h PHE 54 N 9.32 0.27 -3.13 -5.34 -1.00 -1.97 -3.45 116.94 111.64 1wg2 h PHE 54 Ca 0.26 -0.05 -0.42 0.00 2.81 0.00 0.00 57.97 60.57 1wg2 h PHE 54 Cb 0.96 -0.07 0.22 0.00 3.61 0.00 0.00 35.95 40.67 1wg2 h PHE 54 CO 1.31 0.51 -0.04 0.15 -1.61 0.00 0.00 178.31 178.63 1wg2 s LYS 55 N -4.82 -1.64 -0.10 1.51 -0.14 -1.26 -5.05 119.74 108.25 1wg2 s LYS 55 Ca -0.14 0.64 -0.03 0.00 -1.36 0.00 0.00 55.97 55.07 1wg2 s LYS 55 Cb 0.05 -1.49 0.05 0.00 -1.68 0.00 0.00 37.83 34.77 1wg2 s LYS 55 CO 0.71 -4.15 0.15 -1.21 -0.76 0.00 0.00 175.35 170.10 1wg2 s GLU 56 N -4.58 0.04 -0.04 1.68 2.02 -1.26 -5.14 118.70 111.41 1wg2 s GLU 56 Ca 0.69 0.46 -0.02 0.00 0.02 0.00 0.00 54.97 56.11 1wg2 s GLU 56 Cb -0.22 -0.51 0.03 0.00 0.10 0.00 0.00 34.13 33.53 1wg2 s GLU 56 CO 0.63 -0.37 0.10 0.08 0.02 0.00 0.00 175.26 175.72 1wg2 s VAL 57 N 2.27 -0.03 -0.51 2.63 1.01 -1.26 -5.09 120.40 119.41 1wg2 s VAL 57 Ca 0.04 0.12 -0.26 0.00 0.00 0.00 0.00 61.98 61.88 1wg2 s VAL 57 Cb -0.13 -0.17 -0.05 0.00 0.00 0.00 0.00 36.38 36.04 1wg2 s VAL 57 CO -0.06 0.05 2.19 -0.83 0.00 0.00 0.00 175.10 176.45 1wg2 s GLY 58 N 0.75 -0.13 0.20 4.51 0.00 -1.26 -4.90 107.32 106.50 1wg2 s GLY 58 Ca -0.06 -0.15 -0.09 0.00 0.00 0.00 0.00 44.72 44.42 1wg2 s GLY 58 CO -0.03 3.85 0.34 -0.56 0.00 0.00 0.00 173.10 176.69 1wg2 s SER 59 N 10.36 -0.00 0.00 1.64 0.01 -1.26 -5.17 113.70 119.28 1wg2 s SER 59 Ca 0.87 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 57.16 1wg2 s SER 59 Cb -0.17 0.49 0.00 0.00 0.21 0.00 0.00 66.02 66.55 1wg2 s SER 59 CO 0.25 -0.98 0.00 0.61 0.41 0.00 0.00 173.24 173.53 1wg2 n GLY 60 N -0.29 0.53 3.67 3.44 0.00 -1.26 -5.01 105.19 106.28 1wg2 n GLY 60 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1wg2 n GLY 60 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wg2 s PRO 61 N 3.39 4.23 0.85 1.61 0.04 -1.26 -4.98 135.00 138.88 1wg2 s PRO 61 Ca 0.00 2.02 -0.14 0.00 0.04 0.00 0.00 61.00 62.92 1wg2 s PRO 61 Cb 0.00 -3.77 0.03 0.00 0.04 0.00 0.00 34.50 30.80 1wg2 s PRO 61 CO 0.00 -0.71 0.64 0.43 0.04 0.00 0.00 177.00 177.40 1wg2 n SER 62 N 6.28 -1.08 -4.91 6.66 7.64 -1.26 -4.99 113.62 121.96 1wg2 n SER 62 Ca 0.15 0.46 -0.30 0.00 1.01 0.00 0.00 58.87 60.19 1wg2 n SER 62 Cb 0.43 -1.28 -0.04 0.00 -1.01 0.00 0.00 64.21 62.31 1wg2 n SER 62 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wg2 s SER 63 N -1.91 6.44 0.00 6.43 0.15 -1.26 -5.30 113.70 118.25 1wg2 s SER 63 Ca 0.63 0.48 0.15 0.00 0.70 0.00 0.00 55.95 57.91 1wg2 s SER 63 Cb -0.27 -2.04 0.87 0.00 -1.71 0.00 0.00 66.02 62.86 1wg2 s SER 63 CO 0.61 0.03 1.29 0.61 1.20 0.00 0.00 173.24 176.98