#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wfy s SER 2 N 0.00 -0.33 -0.23 1.61 1.04 -1.26 -5.18 113.70 109.35 1wfy s SER 2 Ca 0.00 -0.45 -0.26 0.00 0.48 0.00 0.00 55.95 55.71 1wfy s SER 2 Cb 0.00 0.67 0.10 0.00 0.10 0.00 0.00 66.02 66.88 1wfy s SER 2 CO 0.00 -1.20 0.87 -0.94 0.98 0.00 0.00 173.24 172.94 1wfy s SER 3 N -2.88 -0.58 0.00 7.02 1.04 -1.26 -5.15 113.70 111.90 1wfy s SER 3 Ca 0.09 1.00 0.00 0.00 0.48 0.00 0.00 55.95 57.52 1wfy s SER 3 Cb -0.04 0.98 0.00 0.00 0.10 0.00 0.00 66.02 67.06 1wfy s SER 3 CO 0.01 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.56 1wfy n GLY 4 N 2.02 0.14 1.14 7.32 0.00 -1.26 -5.17 105.19 109.39 1wfy n GLY 4 Ca -0.14 -1.23 0.10 0.00 0.00 0.00 0.00 46.02 44.76 1wfy n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wfy n SER 5 N 0.00 -6.19 -3.71 1.61 2.88 -1.26 -5.07 113.62 101.88 1wfy n SER 5 Ca 0.00 1.22 -0.06 0.00 -1.33 0.00 0.00 58.87 58.70 1wfy n SER 5 Cb 0.00 -3.83 -0.02 0.00 -0.75 0.00 0.00 64.21 59.62 1wfy n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wfy s SER 6 N -6.13 -0.26 0.43 -3.46 0.01 -1.26 -5.13 113.70 97.91 1wfy s SER 6 Ca 0.00 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 56.91 1wfy s SER 6 Cb 0.00 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.77 1wfy s SER 6 CO 0.00 -0.97 0.00 0.61 0.41 0.00 0.00 173.24 173.29 1wfy n GLY 7 N -0.43 2.01 1.43 3.44 0.00 -1.26 -4.95 105.19 105.42 1wfy n GLY 7 Ca -0.07 -0.30 0.17 0.00 0.00 0.00 0.00 46.02 45.81 1wfy n GLY 7 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wfy n ASP 8 N -0.59 -7.56 -1.43 1.61 9.92 -1.26 -4.98 116.55 112.26 1wfy n ASP 8 Ca 0.00 1.42 0.18 0.00 -0.53 0.00 0.00 54.79 55.85 1wfy n ASP 8 Cb 0.00 -4.90 -0.08 0.00 -0.64 0.00 0.00 41.12 35.50 1wfy n ASP 8 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wfy n GLN 9 N -4.33 -3.21 -4.21 -1.24 1.13 -1.26 -4.98 117.38 99.29 1wfy n GLN 9 Ca -0.09 2.52 -0.16 0.00 -1.94 0.00 0.00 57.00 57.32 1wfy n GLN 9 Cb 0.66 -3.78 -0.11 0.00 0.11 0.00 0.00 30.24 27.12 1wfy n GLN 9 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1wfy s GLU 10 N -3.79 0.93 0.94 -1.09 2.02 -1.26 -5.15 118.70 111.31 1wfy s GLU 10 Ca 0.00 -1.19 -0.12 0.00 0.02 0.00 0.00 54.97 53.68 1wfy s GLU 10 Cb 0.00 -0.72 0.15 0.00 0.10 0.00 0.00 34.13 33.66 1wfy s GLU 10 CO 0.00 0.13 1.10 0.14 0.02 0.00 0.00 175.26 176.65 1wfy s VAL 11 N -2.26 2.34 -0.09 2.63 -7.23 -1.26 -4.71 120.40 109.83 1wfy s VAL 11 Ca 0.07 0.11 -0.07 0.00 -1.81 0.00 0.00 61.98 60.28 1wfy s VAL 11 Cb -0.04 -2.64 0.03 0.00 0.56 0.00 0.00 36.38 34.29 1wfy s VAL 11 CO 0.02 -0.15 0.13 0.54 -0.31 0.00 0.00 175.10 175.33 1wfy n ARG 12 N -3.99 -4.73 -3.78 4.82 1.74 -1.26 -4.97 116.66 104.49 1wfy n ARG 12 Ca 0.06 3.52 -0.28 0.00 -0.77 0.00 0.00 57.85 60.38 1wfy n ARG 12 Cb 0.57 -4.78 -0.11 0.00 -1.02 0.00 0.00 32.46 27.11 1wfy n ARG 12 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1wfy n LEU 13 N 1.71 2.33 0.00 0.55 0.00 -1.26 -4.92 117.00 115.41 1wfy n LEU 13 Ca -0.22 -5.05 0.00 0.00 0.00 0.00 0.00 56.01 50.73 1wfy n LEU 13 Cb 0.35 -0.48 0.00 0.00 0.00 0.00 0.00 43.42 43.28 1wfy n LEU 13 CO 0.21 1.79 0.00 1.21 0.00 0.00 0.00 177.39 180.60 1wfy n GLU 14 N 2.09 0.00 0.00 1.96 2.13 -1.26 -4.73 120.64 120.82 1wfy n GLU 14 Ca 0.22 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.04 1wfy n GLU 14 Cb 0.38 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.09 1wfy n GLU 14 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1wfy n ASN 15 N 3.61 0.00 -4.59 4.31 4.13 -1.26 -5.12 115.26 116.34 1wfy n ASN 15 Ca 0.00 0.00 -0.53 0.00 1.68 0.00 0.00 54.58 55.73 1wfy n ASN 15 Cb 0.00 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.18 1wfy n ASN 15 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1wfy n ARG 16 N -0.54 1.05 -4.01 3.52 1.74 -1.26 -4.50 116.66 112.65 1wfy n ARG 16 Ca 0.00 0.38 -0.23 0.00 -0.77 0.00 0.00 57.85 57.22 1wfy n ARG 16 Cb 0.00 -2.01 -0.03 0.00 -1.02 0.00 0.00 32.46 29.40 1wfy n ARG 16 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1wfy s ILE 17 N 0.51 4.98 0.07 0.55 -5.25 -0.53 -4.92 121.20 116.62 1wfy s ILE 17 Ca 0.85 -1.01 0.01 0.00 -0.99 0.00 0.00 60.65 59.51 1wfy s ILE 17 Cb -0.99 -3.64 -0.04 0.00 2.95 0.00 0.00 42.46 40.74 1wfy s ILE 17 CO 0.48 -0.24 -0.06 -0.89 -1.79 0.00 0.00 174.94 172.45 1wfy s THR 18 N -1.91 0.52 0.22 8.37 2.01 -1.26 -1.76 115.64 121.82 1wfy s THR 18 Ca 0.33 -1.75 -0.17 0.00 0.31 0.00 0.00 61.69 60.42 1wfy s THR 18 Cb -0.09 -1.44 0.02 0.00 0.01 0.00 0.00 72.50 71.00 1wfy s THR 18 CO 0.27 -0.83 0.53 0.72 -0.69 0.00 0.00 174.62 174.63 1wfy s PHE 19 N -3.32 -0.02 0.19 4.92 -0.71 -0.33 -4.50 117.98 114.22 1wfy s PHE 19 Ca 0.06 -0.35 0.04 0.00 -1.04 0.00 0.00 56.93 55.65 1wfy s PHE 19 Cb 0.03 0.38 -0.03 0.00 -1.21 0.00 0.00 43.02 42.19 1wfy s PHE 19 CO -0.05 -0.97 0.29 -0.65 -1.34 0.00 0.00 175.22 172.49 1wfy s GLN 20 N -3.91 3.33 -0.02 1.99 -0.21 -1.25 -0.00 119.66 119.58 1wfy s GLN 20 Ca 0.12 -0.73 0.03 0.00 0.02 0.00 0.00 55.36 54.80 1wfy s GLN 20 Cb -0.01 -2.86 -0.00 0.00 1.00 0.00 0.00 33.01 31.13 1wfy s GLN 20 CO 0.01 0.47 -0.11 -1.17 -2.12 0.00 0.00 175.29 172.37 1wfy s LEU 21 N -3.56 1.89 -0.35 2.90 0.20 0.37 -0.91 118.68 119.23 1wfy s LEU 21 Ca 0.34 -0.22 -0.16 0.00 0.69 0.00 0.00 54.13 54.78 1wfy s LEU 21 Cb -0.10 -0.63 -0.01 0.00 -0.43 0.00 0.00 46.19 45.02 1wfy s LEU 21 CO 0.28 0.11 0.39 -0.70 -0.29 0.00 0.00 176.35 176.13 1wfy s GLU 22 N -0.01 3.55 -1.40 1.98 2.12 0.17 -1.88 118.70 123.24 1wfy s GLU 22 Ca -0.00 -0.39 -0.12 0.00 0.36 0.00 0.00 54.97 54.81 1wfy s GLU 22 Cb -0.07 -3.81 0.08 0.00 0.26 0.00 0.00 34.13 30.59 1wfy s GLU 22 CO 0.00 -0.55 2.10 1.28 -0.54 0.00 0.00 175.26 177.55 1wfy n LEU 23 N 5.44 6.78 -4.22 2.70 4.77 -1.25 -0.25 117.00 130.97 1wfy n LEU 23 Ca -0.08 -4.32 -0.55 0.00 -0.03 0.00 0.00 56.01 51.03 1wfy n LEU 23 Cb 0.49 -1.60 -0.12 0.00 -2.33 0.00 0.00 43.42 39.86 1wfy n LEU 23 CO 0.41 1.20 1.79 0.52 -1.33 0.00 0.00 177.39 179.98 1wfy n VAL 24 N 4.49 0.00 0.00 4.08 0.31 -1.22 -0.06 118.33 125.92 1wfy n VAL 24 Ca 0.48 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.81 1wfy n VAL 24 Cb 0.38 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.82 1wfy n VAL 24 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wfy n GLY 25 N 7.18 1.47 3.32 2.92 0.00 -1.26 -4.88 105.19 113.94 1wfy n GLY 25 Ca 0.56 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.47 1wfy n GLY 25 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wfy s LEU 26 N 0.00 0.36 -0.92 0.99 1.43 0.91 -5.08 118.68 116.36 1wfy s LEU 26 Ca 0.00 -0.29 -0.00 0.00 -1.03 0.00 0.00 54.13 52.81 1wfy s LEU 26 Cb 0.00 1.87 0.31 0.00 0.03 0.00 0.00 46.19 48.40 1wfy s LEU 26 CO 0.00 -0.85 1.46 -1.84 0.23 0.00 0.00 176.35 175.35 1wfy n GLU 27 N -0.20 4.47 -3.67 1.70 0.28 -1.26 -4.69 120.64 117.27 1wfy n GLU 27 Ca -0.16 -4.67 -0.09 0.00 -0.16 0.00 0.00 57.16 52.08 1wfy n GLU 27 Cb 0.64 -2.42 -0.09 0.00 1.43 0.00 0.00 31.44 31.00 1wfy n GLU 27 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 1wfy s ARG 28 N -3.54 0.50 -0.50 3.44 1.70 -1.26 -5.12 118.95 114.17 1wfy s ARG 28 Ca 0.38 0.99 -0.16 0.00 -0.47 0.00 0.00 55.73 56.47 1wfy s ARG 28 Cb 0.16 0.10 0.09 0.00 -0.57 0.00 0.00 34.95 34.73 1wfy s ARG 28 CO -0.05 -0.17 0.47 0.08 -1.08 0.00 0.00 175.30 174.56 1wfy s VAL 29 N 1.65 5.16 0.45 4.99 1.01 -1.26 -3.89 120.40 128.51 1wfy s VAL 29 Ca -0.09 -1.11 -0.19 0.00 0.00 0.00 0.00 61.98 60.59 1wfy s VAL 29 Cb -0.08 -4.23 -0.10 0.00 0.00 0.00 0.00 36.38 31.98 1wfy s VAL 29 CO -0.15 -0.72 0.95 0.68 0.00 0.00 0.00 175.10 175.86 1wfy s VAL 30 N 1.81 4.45 0.13 2.92 -7.23 -0.79 -4.81 120.40 116.88 1wfy s VAL 30 Ca 0.06 1.38 0.08 0.00 -1.81 0.00 0.00 61.98 61.69 1wfy s VAL 30 Cb -0.25 -3.63 -0.04 0.00 0.56 0.00 0.00 36.38 33.01 1wfy s VAL 30 CO 0.06 -0.42 -0.13 -0.60 -0.31 0.00 0.00 175.10 173.71 1wfy s ARG 31 N -3.42 1.99 -0.04 4.82 6.06 -1.26 0.14 118.95 127.25 1wfy s ARG 31 Ca 0.61 -1.14 0.02 0.00 -2.50 0.00 0.00 55.73 52.72 1wfy s ARG 31 Cb -0.09 -2.20 0.01 0.00 0.06 0.00 0.00 34.95 32.72 1wfy s ARG 31 CO 0.18 0.48 -0.08 0.42 -2.50 0.00 0.00 175.30 173.80 1wfy s ILE 32 N -1.31 0.77 -0.05 4.11 1.01 1.00 -4.94 121.20 121.78 1wfy s ILE 32 Ca 0.21 -0.31 0.05 0.00 0.00 0.00 0.00 60.65 60.60 1wfy s ILE 32 Cb -0.10 -0.71 -0.01 0.00 0.01 0.00 0.00 42.46 41.65 1wfy s ILE 32 CO 0.13 0.26 -0.21 -0.94 0.00 0.00 0.00 174.94 174.17 1wfy s SER 33 N 0.47 2.64 -0.20 3.58 1.04 -1.26 -1.19 113.70 118.79 1wfy s SER 33 Ca -0.08 -0.44 -0.36 0.00 0.48 0.00 0.00 55.95 55.56 1wfy s SER 33 Cb -0.11 -0.75 0.14 0.00 0.10 0.00 0.00 66.02 65.40 1wfy s SER 33 CO 0.01 0.20 1.28 0.00 0.98 0.00 0.00 173.24 175.70 1wfy s ALA 34 N -0.04 -2.15 0.75 5.32 0.00 -0.72 -5.03 121.76 119.88 1wfy s ALA 34 Ca -0.04 1.57 -0.15 0.00 0.00 0.00 0.00 51.96 53.33 1wfy s ALA 34 Cb -0.13 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 22.88 1wfy s ALA 34 CO 0.03 -0.65 1.02 0.36 0.00 0.00 0.00 175.76 176.52 1wfy n LYS 35 N -0.13 0.44 0.02 0.00 0.00 -1.26 -1.45 118.16 115.78 1wfy n LYS 35 Ca 0.01 0.21 -0.10 0.00 -0.00 0.00 0.00 58.31 58.43 1wfy n LYS 35 Cb 0.58 -2.28 -0.07 0.00 -0.00 0.00 0.00 35.03 33.26 1wfy n LYS 35 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 1wfy h PRO 36 N -0.41 -0.15 -0.93 -1.58 0.13 -1.88 -3.33 132.00 123.85 1wfy h PRO 36 Ca -0.47 0.01 0.12 0.00 -0.87 0.00 0.00 66.00 64.79 1wfy h PRO 36 Cb 1.32 0.03 -0.14 0.00 0.13 0.00 0.00 31.00 32.35 1wfy h PRO 36 CO 0.46 0.31 -0.42 0.25 -0.23 0.00 0.00 178.00 178.37 1wfy n THR 37 N -4.86 -0.54 -0.93 1.56 -2.24 -1.26 -3.04 114.28 102.98 1wfy n THR 37 Ca -0.07 2.21 -0.36 0.00 -2.27 0.00 0.00 64.05 63.56 1wfy n THR 37 Cb 0.26 -2.85 0.07 0.00 -2.10 0.00 0.00 70.33 65.71 1wfy n THR 37 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1wfy n LYS 38 N -5.30 -0.26 -1.59 -0.78 5.02 -1.25 -4.69 118.16 109.30 1wfy n LYS 38 Ca 0.07 -0.07 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 1wfy n LYS 38 Cb 0.33 -1.21 0.06 0.00 -0.02 0.00 0.00 35.03 34.19 1wfy n LYS 38 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1wfy n ARG 39 N 1.31 0.26 0.15 1.97 1.74 -1.26 -2.73 116.66 118.09 1wfy n ARG 39 Ca -0.00 -1.35 0.07 0.00 -0.77 0.00 0.00 57.85 55.80 1wfy n ARG 39 Cb 0.63 -0.33 0.06 0.00 -1.02 0.00 0.00 32.46 31.80 1wfy n ARG 39 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1wfy h LEU 40 N 0.00 0.00 0.08 0.55 3.38 0.18 -1.79 115.31 117.71 1wfy h LEU 40 Ca -0.16 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.48 1wfy h LEU 40 Cb 0.61 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 1wfy h LEU 40 CO 0.18 0.24 -1.80 0.06 0.09 0.00 0.00 178.44 177.21 1wfy h GLN 41 N 0.00 0.17 0.00 1.13 3.07 -1.83 -2.85 115.11 114.80 1wfy h GLN 41 Ca -0.02 -0.30 -0.13 0.00 0.09 0.00 0.00 58.65 58.29 1wfy h GLN 41 Cb 1.20 0.11 -0.02 0.00 0.08 0.00 0.00 27.48 28.86 1wfy h GLN 41 CO 0.03 0.95 -0.61 0.93 0.09 0.00 0.00 178.83 180.21 1wfy h GLU 42 N 0.05 0.00 0.00 0.06 4.39 -1.88 0.41 114.58 117.61 1wfy h GLU 42 Ca -0.34 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.24 1wfy h GLU 42 Cb 2.02 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.66 1wfy h GLU 42 CO 0.10 0.61 -0.76 0.00 -1.16 0.00 0.00 179.01 177.80 1wfy h ALA 43 N 1.39 0.66 0.00 3.43 0.00 -1.45 -3.20 119.26 120.08 1wfy h ALA 43 Ca -0.01 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1wfy h ALA 43 Cb 1.37 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1wfy h ALA 43 CO 0.08 0.69 -0.94 1.28 0.00 0.00 0.00 179.25 180.36 1wfy n LEU 44 N -3.12 0.64 -0.12 0.00 7.99 -1.08 -4.16 117.00 117.16 1wfy n LEU 44 Ca -0.01 0.09 -0.05 0.00 -0.01 0.00 0.00 56.01 56.03 1wfy n LEU 44 Cb 0.76 -0.12 0.01 0.00 -0.11 0.00 0.00 43.42 43.97 1wfy n LEU 44 CO 0.41 -0.01 0.78 1.56 -1.51 0.00 0.00 177.39 178.62 1wfy h GLN 45 N 0.00 -0.01 0.00 3.23 1.08 -0.90 1.71 115.11 120.22 1wfy h GLN 45 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1wfy h GLN 45 Cb 0.77 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.20 1wfy h GLN 45 CO 0.00 -0.00 0.00 -0.35 -0.95 0.00 0.00 178.83 177.53 1wfy n PRO 46 N -5.31 0.52 -0.14 1.46 -0.04 -1.26 -1.68 135.00 128.55 1wfy n PRO 46 Ca 0.02 0.04 -0.27 0.00 -0.04 0.00 0.00 63.50 63.25 1wfy n PRO 46 Cb 0.22 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.08 1wfy n PRO 46 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1wfy n ILE 47 N -1.15 1.49 -0.14 0.52 2.08 0.17 -3.62 119.36 118.70 1wfy n ILE 47 Ca 0.14 -0.42 -0.09 0.00 0.56 0.00 0.00 62.75 62.94 1wfy n ILE 47 Cb 0.14 -1.78 -0.01 0.00 -0.75 0.00 0.00 39.64 37.24 1wfy n ILE 47 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1wfy h LEU 48 N -0.78 0.56 -1.49 1.39 3.38 0.23 0.25 115.31 118.85 1wfy h LEU 48 Ca -0.67 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.09 1wfy h LEU 48 Cb 1.66 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.26 1wfy h LEU 48 CO -0.35 0.56 -0.20 0.00 0.09 0.00 0.00 178.44 178.54 1wfy h ALA 49 N 1.02 1.58 -0.01 1.53 0.00 -1.49 1.70 119.26 123.58 1wfy h ALA 49 Ca 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1wfy h ALA 49 Cb 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1wfy h ALA 49 CO -0.01 0.31 -0.02 1.17 0.00 0.00 0.00 179.25 180.70 1wfy n LYS 50 N -4.27 1.41 0.00 0.00 4.81 -0.71 -3.32 118.16 116.08 1wfy n LYS 50 Ca -0.02 -0.68 0.00 0.00 -0.87 0.00 0.00 58.31 56.74 1wfy n LYS 50 Cb 0.28 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.84 1wfy n LYS 50 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1wfy n HIS 51 N -0.20 0.00 -1.30 5.64 8.25 0.79 -4.98 115.22 123.43 1wfy n HIS 51 Ca 0.19 -0.18 -0.10 0.00 -0.26 0.00 0.00 57.72 57.37 1wfy n HIS 51 Cb 0.30 -0.02 -0.04 0.00 1.12 0.00 0.00 29.99 31.34 1wfy n HIS 51 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wfy n GLY 52 N -0.18 1.07 0.00 -1.41 0.00 0.45 -4.97 105.19 100.16 1wfy n GLY 52 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1wfy n GLY 52 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wfy n LEU 53 N -1.16 0.00 -3.99 0.99 4.77 0.47 -4.95 117.00 113.12 1wfy n LEU 53 Ca -0.10 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.75 1wfy n LEU 53 Cb 0.48 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.55 1wfy n LEU 53 CO 0.16 -0.39 0.28 -0.44 -1.33 0.00 0.00 177.39 175.67 1wfy s SER 54 N -1.00 0.65 0.13 -1.43 0.01 -1.26 -4.18 113.70 106.61 1wfy s SER 54 Ca 0.00 -1.39 0.23 0.00 1.31 0.00 0.00 55.95 56.10 1wfy s SER 54 Cb 0.00 0.74 0.19 0.00 0.21 0.00 0.00 66.02 67.16 1wfy s SER 54 CO 0.00 -1.45 1.19 -0.07 0.41 0.00 0.00 173.24 173.32 1wfy h LEU 55 N 2.06 0.00 -3.12 2.44 3.38 -1.95 -3.08 115.31 115.03 1wfy h LEU 55 Ca -0.30 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1wfy h LEU 55 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1wfy h LEU 55 CO 0.39 0.09 0.00 -0.67 0.09 0.00 0.00 178.44 178.34 1wfy n ASP 56 N -2.25 3.91 -0.02 -0.43 2.03 -1.26 -4.45 116.55 114.08 1wfy n ASP 56 Ca 0.02 -2.52 -0.03 0.00 0.52 0.00 0.00 54.79 52.78 1wfy n ASP 56 Cb 0.47 -0.46 -0.01 0.00 -0.72 0.00 0.00 41.12 40.40 1wfy n ASP 56 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1wfy n GLN 57 N 0.34 0.07 -3.98 -0.67 1.13 -1.23 -5.04 117.38 107.99 1wfy n GLN 57 Ca 0.20 0.02 -0.30 0.00 -1.94 0.00 0.00 57.00 54.98 1wfy n GLN 57 Cb 0.76 -0.88 -0.05 0.00 0.11 0.00 0.00 30.24 30.17 1wfy n GLN 57 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1wfy s VAL 58 N -2.06 4.99 -0.13 5.09 -7.23 -1.17 -2.78 120.40 117.11 1wfy s VAL 58 Ca -0.04 -0.59 0.02 0.00 -1.81 0.00 0.00 61.98 59.56 1wfy s VAL 58 Cb 0.01 -3.43 0.01 0.00 0.56 0.00 0.00 36.38 33.53 1wfy s VAL 58 CO 0.06 0.11 -0.20 -0.69 -0.31 0.00 0.00 175.10 174.07 1wfy s VAL 59 N -1.48 1.91 -0.03 1.32 1.01 -0.81 -4.79 120.40 117.52 1wfy s VAL 59 Ca 0.32 -0.89 -0.14 0.00 0.00 0.00 0.00 61.98 61.28 1wfy s VAL 59 Cb -0.12 -1.70 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 1wfy s VAL 59 CO 0.25 0.52 0.36 -0.22 0.00 0.00 0.00 175.10 176.02 1wfy s LEU 60 N 0.88 4.44 -0.25 3.92 1.98 -1.26 -1.45 118.68 126.94 1wfy s LEU 60 Ca -0.06 0.86 -0.29 0.00 -2.89 0.00 0.00 54.13 51.75 1wfy s LEU 60 Cb -0.15 -2.50 0.17 0.00 0.66 0.00 0.00 46.19 44.37 1wfy s LEU 60 CO -0.02 0.32 1.26 -1.38 -1.89 0.00 0.00 176.35 174.64 1wfy s HIS 61 N -0.93 -0.14 0.62 5.38 -3.43 -0.62 -1.20 115.29 114.96 1wfy s HIS 61 Ca 0.22 0.26 -0.12 0.00 -0.80 0.00 0.00 55.06 54.62 1wfy s HIS 61 Cb -0.16 0.48 -0.03 0.00 -1.43 0.00 0.00 32.58 31.44 1wfy s HIS 61 CO 0.11 -0.12 1.03 1.03 -2.00 0.00 0.00 174.74 174.80 1wfy s ARG 62 N -0.87 3.45 -0.64 -0.38 0.52 -1.26 0.17 118.95 119.94 1wfy s ARG 62 Ca 0.06 0.89 -0.27 0.00 -0.52 0.00 0.00 55.73 55.88 1wfy s ARG 62 Cb -0.01 -2.06 0.01 0.00 0.52 0.00 0.00 34.95 33.40 1wfy s ARG 62 CO -0.06 -0.69 1.54 -1.25 0.02 0.00 0.00 175.30 174.86 1wfy s PRO 63 N -4.84 3.01 0.00 3.54 0.04 -1.26 -2.96 135.00 132.54 1wfy s PRO 63 Ca 0.57 0.29 0.00 0.00 0.04 0.00 0.00 61.00 61.90 1wfy s PRO 63 Cb -0.12 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.18 1wfy s PRO 63 CO 0.49 -2.31 0.00 0.41 0.04 0.00 0.00 177.00 175.63 1wfy n GLY 64 N 5.47 4.08 3.51 0.56 0.00 -1.26 -5.11 105.19 112.44 1wfy n GLY 64 Ca 0.12 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 1wfy n GLY 64 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wfy n GLU 65 N 0.00 0.81 0.00 1.61 -0.58 -1.15 -4.95 120.64 116.38 1wfy n GLU 65 Ca 0.00 0.29 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 1wfy n GLU 65 Cb 0.00 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.15 1wfy n GLU 65 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1wfy n LYS 66 N 0.30 0.00 -2.19 3.49 3.00 -1.26 -4.89 118.16 116.62 1wfy n LYS 66 Ca 0.11 0.44 -0.29 0.00 -0.00 0.00 0.00 58.31 58.57 1wfy n LYS 66 Cb 0.40 -1.08 0.01 0.00 0.00 0.00 0.00 35.03 34.36 1wfy n LYS 66 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 1wfy s GLN 67 N -1.42 3.39 0.19 1.64 -2.07 -1.26 -5.03 119.66 115.09 1wfy s GLN 67 Ca 0.00 0.43 -0.30 0.00 -1.82 0.00 0.00 55.36 53.67 1wfy s GLN 67 Cb 0.00 -2.19 -0.08 0.00 -1.09 0.00 0.00 33.01 29.65 1wfy s GLN 67 CO 0.00 -0.53 1.11 -1.25 -1.32 0.00 0.00 175.29 173.30 1wfy s PRO 68 N -5.04 4.59 0.74 9.60 0.04 -1.26 -4.87 135.00 138.79 1wfy s PRO 68 Ca 0.53 1.75 -0.15 0.00 0.04 0.00 0.00 61.00 63.17 1wfy s PRO 68 Cb -0.11 -3.26 0.05 0.00 0.04 0.00 0.00 34.50 31.22 1wfy s PRO 68 CO 0.50 0.07 1.20 -1.64 0.04 0.00 0.00 177.00 177.17 1wfy s MET 69 N -0.49 2.07 -0.30 4.56 -1.94 -0.34 -4.97 119.30 117.89 1wfy s MET 69 Ca 0.49 1.74 -0.18 0.00 -1.71 0.00 0.00 55.69 56.03 1wfy s MET 69 Cb -0.30 -1.83 -0.02 0.00 2.01 0.00 0.00 34.83 34.69 1wfy s MET 69 CO 0.36 -1.88 0.51 -0.51 -0.01 0.00 0.00 175.02 173.49 1wfy s ASP 70 N -2.10 6.38 0.58 3.03 1.01 -1.26 -4.62 116.67 119.69 1wfy s ASP 70 Ca 0.74 0.30 0.28 0.00 0.71 0.00 0.00 52.55 54.58 1wfy s ASP 70 Cb -0.29 -2.27 1.58 0.00 1.01 0.00 0.00 42.92 42.95 1wfy s ASP 70 CO 0.46 -0.36 2.06 -0.07 0.21 0.00 0.00 175.17 177.47 1wfy h LEU 71 N 8.91 0.00 -1.54 1.23 3.38 -1.92 0.32 115.31 125.69 1wfy h LEU 71 Ca -0.29 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.80 1wfy h LEU 71 Cb 1.14 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1wfy h LEU 71 CO 0.74 0.00 0.66 -0.33 0.09 0.00 0.00 178.44 179.60 1wfy h GLU 72 N 0.00 0.00 -6.98 1.13 5.08 -1.94 0.47 114.58 112.34 1wfy h GLU 72 Ca 0.12 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.99 1wfy h GLU 72 Cb 0.64 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.92 1wfy h GLU 72 CO -0.00 0.00 0.43 -0.80 -1.00 0.00 0.00 179.01 177.64 1wfy s ASN 73 N -4.39 6.58 0.25 1.42 0.01 0.10 -4.69 114.94 114.23 1wfy s ASN 73 Ca -0.03 2.10 -0.30 0.00 -0.71 0.00 0.00 52.86 53.92 1wfy s ASN 73 Cb 0.12 -2.59 -0.09 0.00 0.41 0.00 0.00 41.25 39.10 1wfy s ASN 73 CO 0.40 -0.62 1.09 -2.16 -1.51 0.00 0.00 177.10 174.30 1wfy s PRO 74 N -2.60 4.64 0.57 -0.60 0.04 -1.26 -0.99 135.00 134.81 1wfy s PRO 74 Ca 0.60 1.77 0.32 0.00 0.04 0.00 0.00 61.00 63.72 1wfy s PRO 74 Cb -0.23 -3.22 1.74 0.00 0.04 0.00 0.00 34.50 32.83 1wfy s PRO 74 CO 0.29 0.20 1.97 -0.39 0.04 0.00 0.00 177.00 179.10 1wfy h VAL 75 N 3.25 0.00 0.00 -0.36 -1.51 -1.43 0.28 116.25 116.48 1wfy h VAL 75 Ca -0.46 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.01 1wfy h VAL 75 Cb 1.21 0.71 -0.00 0.00 -2.13 0.00 0.00 31.29 31.08 1wfy h VAL 75 CO 0.68 0.00 -0.01 -1.28 -1.23 0.00 0.00 177.57 175.73 1wfy h SER 76 N 0.00 0.00 0.73 4.19 0.87 -1.79 0.25 113.55 117.79 1wfy h SER 76 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1wfy h SER 76 Cb 0.32 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1wfy h SER 76 CO 0.00 0.01 -0.93 -0.24 -0.53 0.00 0.00 176.83 175.14 1wfy n SER 77 N -3.49 0.69 -1.66 6.23 2.88 0.97 -3.88 113.62 115.36 1wfy n SER 77 Ca -0.03 0.08 -0.16 0.00 -1.33 0.00 0.00 58.87 57.42 1wfy n SER 77 Cb 0.10 0.53 0.12 0.00 -0.75 0.00 0.00 64.21 64.22 1wfy n SER 77 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1wfy n VAL 78 N -2.25 2.76 -0.51 2.46 0.24 0.77 -4.61 118.33 117.20 1wfy n VAL 78 Ca 0.01 -3.23 -0.07 0.00 -2.04 0.00 0.00 64.34 59.01 1wfy n VAL 78 Cb 0.48 -0.73 0.21 0.00 -1.47 0.00 0.00 33.84 32.33 1wfy n VAL 78 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1wfy n ALA 79 N -0.96 4.17 -3.33 2.33 0.00 -0.65 -4.56 120.51 117.50 1wfy n ALA 79 Ca 0.43 -1.77 -0.14 0.00 0.00 0.00 0.00 53.44 51.95 1wfy n ALA 79 Cb 0.96 -1.22 -0.09 0.00 0.00 0.00 0.00 19.45 19.11 1wfy n ALA 79 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1wfy s SER 80 N -0.62 -0.39 0.10 0.00 1.04 -1.26 -4.82 113.70 107.75 1wfy s SER 80 Ca 0.41 0.57 0.00 0.00 0.48 0.00 0.00 55.95 57.41 1wfy s SER 80 Cb 0.33 0.63 0.00 0.00 0.10 0.00 0.00 66.02 67.08 1wfy s SER 80 CO 0.10 -0.33 0.00 1.67 0.98 0.00 0.00 173.24 175.65 1wfy n GLN 81 N 1.96 -0.82 -4.26 4.02 7.27 -1.26 -4.85 117.38 119.42 1wfy n GLN 81 Ca -0.17 0.56 -0.34 0.00 0.07 0.00 0.00 57.00 57.11 1wfy n GLN 81 Cb 0.57 -1.00 -0.13 0.00 2.41 0.00 0.00 30.24 32.09 1wfy n GLN 81 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1wfy s THR 82 N -1.53 3.65 0.82 1.69 2.01 -1.26 -3.94 115.64 117.07 1wfy s THR 82 Ca 0.00 -0.43 -0.10 0.00 0.31 0.00 0.00 61.69 61.48 1wfy s THR 82 Cb 0.00 -2.62 0.13 0.00 0.01 0.00 0.00 72.50 70.02 1wfy s THR 82 CO 0.00 0.46 1.15 -0.76 -0.69 0.00 0.00 174.62 174.78 1wfy s LEU 83 N 0.79 2.78 -0.03 4.42 1.43 -0.09 -4.16 118.68 123.82 1wfy s LEU 83 Ca -0.02 0.25 0.04 0.00 -1.03 0.00 0.00 54.13 53.37 1wfy s LEU 83 Cb -0.15 -2.58 -0.01 0.00 0.03 0.00 0.00 46.19 43.49 1wfy s LEU 83 CO 0.02 -2.12 -0.16 -0.69 0.23 0.00 0.00 176.35 173.63 1wfy s VAL 84 N -3.51 1.33 -0.08 -1.59 1.01 0.45 0.43 120.40 118.45 1wfy s VAL 84 Ca 0.67 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1wfy s VAL 84 Cb -0.07 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 1wfy s VAL 84 CO 0.48 0.38 -0.07 -0.22 0.00 0.00 0.00 175.10 175.68 1wfy s LEU 85 N -0.11 3.17 -0.40 3.92 1.98 0.65 -1.59 118.68 126.30 1wfy s LEU 85 Ca 0.00 -0.04 0.02 0.00 -2.89 0.00 0.00 54.13 51.23 1wfy s LEU 85 Cb -0.09 -1.69 0.12 0.00 0.66 0.00 0.00 46.19 45.18 1wfy s LEU 85 CO 0.01 0.34 0.16 -0.62 -1.89 0.00 0.00 176.35 174.35 1wfy s ASP 86 N -0.69 4.20 0.68 3.68 2.15 -0.53 -3.46 116.67 122.69 1wfy s ASP 86 Ca 0.11 -2.34 -0.13 0.00 0.43 0.00 0.00 52.55 50.62 1wfy s ASP 86 Cb -0.11 -1.29 0.01 0.00 -0.30 0.00 0.00 42.92 41.23 1wfy s ASP 86 CO 0.02 -0.33 1.08 0.42 -0.17 0.00 0.00 175.17 176.19 1wfy s THR 87 N 0.68 3.58 0.75 1.71 -4.23 -1.26 -1.93 115.64 114.93 1wfy s THR 87 Ca 0.14 0.63 -0.11 0.00 -1.18 0.00 0.00 61.69 61.16 1wfy s THR 87 Cb -0.22 -3.19 0.04 0.00 1.34 0.00 0.00 72.50 70.48 1wfy s THR 87 CO -0.08 -0.56 1.08 -2.16 -0.54 0.00 0.00 174.62 172.36 1wfy s PRO 88 N -4.52 2.49 0.71 3.99 0.04 -1.12 -4.96 135.00 131.64 1wfy s PRO 88 Ca 0.63 0.79 -0.11 0.00 0.04 0.00 0.00 61.00 62.35 1wfy s PRO 88 Cb -0.17 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.43 1wfy s PRO 88 CO 0.47 -1.37 1.07 -1.25 0.04 0.00 0.00 177.00 175.95 1wfy s PRO 89 N -5.10 2.80 -0.07 0.56 0.04 -1.26 -4.52 135.00 127.45 1wfy s PRO 89 Ca 0.59 0.91 -0.01 0.00 0.04 0.00 0.00 61.00 62.53 1wfy s PRO 89 Cb -0.14 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1wfy s PRO 89 CO 0.55 -1.18 0.02 -3.47 0.04 0.00 0.00 177.00 172.95 1wfy n ASP 90 N -3.18 -6.63 -3.07 6.66 2.03 -1.26 -4.98 116.55 106.13 1wfy n ASP 90 Ca 0.07 0.77 -0.18 0.00 0.52 0.00 0.00 54.79 55.98 1wfy n ASP 90 Cb 0.54 -2.51 -0.04 0.00 -0.72 0.00 0.00 41.12 38.39 1wfy n ASP 90 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1wfy n ALA 91 N 1.47 0.90 -3.52 -1.67 0.00 -1.26 -4.97 120.51 111.45 1wfy n ALA 91 Ca -0.03 -2.43 -0.17 0.00 0.00 0.00 0.00 53.44 50.81 1wfy n ALA 91 Cb 0.32 -1.04 0.01 0.00 0.00 0.00 0.00 19.45 18.74 1wfy n ALA 91 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1wfy n LYS 92 N 2.15 -1.40 0.09 0.00 5.02 -1.26 -4.92 118.16 117.83 1wfy n LYS 92 Ca 0.20 0.98 -0.10 0.00 -2.02 0.00 0.00 58.31 57.38 1wfy n LYS 92 Cb 0.54 -3.74 -0.06 0.00 -0.02 0.00 0.00 35.03 31.75 1wfy n LYS 92 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1wfy h MET 93 N -0.24 -0.30 -6.42 1.97 2.86 -2.01 -3.48 114.93 107.32 1wfy h MET 93 Ca -0.41 0.02 -0.36 0.00 -2.06 0.00 0.00 59.70 56.89 1wfy h MET 93 Cb 1.25 0.07 0.01 0.00 0.06 0.00 0.00 31.60 32.99 1wfy h MET 93 CO 0.36 0.04 -1.02 0.45 1.06 0.00 0.00 176.91 177.80 1wfy n SER 94 N -4.98 -5.68 -2.69 1.22 2.88 -1.26 -4.97 113.62 98.14 1wfy n SER 94 Ca -0.07 -0.36 -0.01 0.00 -1.33 0.00 0.00 58.87 57.10 1wfy n SER 94 Cb 0.24 -2.28 0.02 0.00 -0.75 0.00 0.00 64.21 61.44 1wfy n SER 94 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1wfy s GLU 95 N -3.36 0.12 0.36 -1.46 2.56 -1.26 -5.15 118.70 110.51 1wfy s GLU 95 Ca 0.21 -0.09 -0.25 0.00 0.00 0.00 0.00 54.97 54.84 1wfy s GLU 95 Cb -0.03 0.00 -0.09 0.00 2.00 0.00 0.00 34.13 36.01 1wfy s GLU 95 CO 0.86 -0.17 1.03 0.00 -0.56 0.00 0.00 175.26 176.43 1wfy s ALA 96 N 1.47 3.17 0.00 6.30 0.00 -1.26 -5.00 121.76 126.45 1wfy s ALA 96 Ca 0.19 0.69 0.00 0.00 0.00 0.00 0.00 51.96 52.84 1wfy s ALA 96 Cb 0.09 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.95 1wfy s ALA 96 CO -0.13 -0.11 0.00 -2.13 0.00 0.00 0.00 175.76 173.38 1wfy n ARG 97 N 0.30 0.00 -2.91 0.00 0.63 -1.26 -5.07 116.66 108.35 1wfy n ARG 97 Ca 0.03 0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 56.95 1wfy n ARG 97 Cb 0.49 0.00 -0.01 0.00 0.45 0.00 0.00 32.46 33.38 1wfy n ARG 97 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1wfy n SER 98 N 0.00 -5.44 -0.27 6.15 7.64 -1.26 -4.80 113.62 115.64 1wfy n SER 98 Ca 0.00 1.04 -0.10 0.00 1.01 0.00 0.00 58.87 60.82 1wfy n SER 98 Cb 0.00 -3.27 -0.07 0.00 -1.01 0.00 0.00 64.21 59.86 1wfy n SER 98 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1wfy h SER 99 N 4.14 -1.81 -3.71 6.43 0.02 -1.99 -3.47 113.55 113.16 1wfy h SER 99 Ca -0.16 0.28 0.27 0.00 -0.84 0.00 0.00 61.79 61.34 1wfy h SER 99 Cb 0.58 0.80 -0.15 0.00 0.14 0.00 0.00 62.40 63.77 1wfy h SER 99 CO 0.02 -0.32 -1.07 0.61 -1.14 0.00 0.00 176.83 174.93 1wfy n GLY 100 N -1.36 -3.34 3.76 -3.77 0.00 -1.26 -4.83 105.19 94.39 1wfy n GLY 100 Ca 0.01 -1.09 -0.40 0.00 0.00 0.00 0.00 46.02 44.53 1wfy n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wfy s PRO 101 N -4.20 4.66 -0.11 1.61 0.04 -1.26 -5.04 135.00 130.69 1wfy s PRO 101 Ca 0.00 1.77 -0.04 0.00 0.04 0.00 0.00 61.00 62.76 1wfy s PRO 101 Cb 0.00 -3.21 0.06 0.00 0.04 0.00 0.00 34.50 31.39 1wfy s PRO 101 CO 0.00 0.23 0.22 0.45 0.04 0.00 0.00 177.00 177.94 1wfy s SER 102 N -0.82 0.48 0.59 6.66 0.15 -1.26 -5.11 113.70 114.39 1wfy s SER 102 Ca 0.45 0.48 0.00 0.00 0.70 0.00 0.00 55.95 57.58 1wfy s SER 102 Cb -0.31 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 1wfy s SER 102 CO 0.40 -0.24 0.00 -0.24 1.20 0.00 0.00 173.24 174.36 1wfy n SER 103 N 5.28 -7.65 -0.10 5.45 2.88 -1.26 -5.31 113.62 112.91 1wfy n SER 103 Ca -0.07 1.37 0.16 0.00 -1.33 0.00 0.00 58.87 59.00 1wfy n SER 103 Cb 0.50 -4.86 0.86 0.00 -0.75 0.00 0.00 64.21 59.96 1wfy n SER 103 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42