#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 -0.30 0.13 1.61 1.04 -1.26 -5.19 113.70 109.73 1wfy s SER 2 Ca 0.00 -0.52 -0.15 0.00 0.48 0.00 0.00 55.95 55.76 1wfy s SER 2 Cb 0.00 0.71 0.02 0.00 0.10 0.00 0.00 66.02 66.85 1wfy s SER 2 CO 0.00 -1.29 0.38 -0.55 0.98 0.00 0.00 173.24 172.75 1wfy s SER 3 N -2.90 -0.16 0.00 7.02 0.15 -1.26 -5.17 113.70 111.39 1wfy s SER 3 Ca 0.10 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.31 1wfy s SER 3 Cb -0.05 0.46 0.00 0.00 -1.71 0.00 0.00 66.02 64.72 1wfy s SER 3 CO 0.04 -0.87 0.00 0.61 1.20 0.00 0.00 173.24 174.23 1wfy n GLY 4 N -0.22 2.98 1.43 9.45 0.00 -1.26 -5.17 105.19 112.40 1wfy n GLY 4 Ca -0.14 -1.38 0.15 0.00 0.00 0.00 0.00 46.02 44.64 1wfy n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wfy n SER 5 N 0.00 -7.73 -3.63 1.61 7.64 -1.26 -5.07 113.62 105.17 1wfy n SER 5 Ca 0.00 1.49 -0.02 0.00 1.01 0.00 0.00 58.87 61.36 1wfy n SER 5 Cb 0.00 -4.87 -0.02 0.00 -1.01 0.00 0.00 64.21 58.31 1wfy n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1wfy s SER 6 N -6.93 -0.01 0.00 6.43 1.04 -1.26 -5.19 113.70 107.78 1wfy s SER 6 Ca 0.00 -0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.43 1wfy s SER 6 Cb 0.00 0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.13 1wfy s SER 6 CO 0.00 -0.02 0.00 0.61 0.98 0.00 0.00 173.24 174.81 1wfy n GLY 7 N -0.07 -1.02 3.93 7.32 0.00 -1.26 -5.16 105.19 108.92 1wfy n GLY 7 Ca 0.04 -1.03 -0.25 0.00 0.00 0.00 0.00 46.02 44.77 1wfy n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wfy s ASP 8 N 0.00 6.25 0.36 1.61 1.01 -1.26 -5.07 116.67 119.57 1wfy s ASP 8 Ca 0.00 0.64 0.04 0.00 0.71 0.00 0.00 52.55 53.94 1wfy s ASP 8 Cb 0.00 -2.09 -0.06 0.00 1.01 0.00 0.00 42.92 41.78 1wfy s ASP 8 CO 0.00 -0.44 0.06 -1.10 0.21 0.00 0.00 175.17 173.90 1wfy s GLN 9 N -4.51 1.75 0.00 8.23 -0.21 -1.26 -5.15 119.66 118.51 1wfy s GLN 9 Ca 0.43 -2.00 0.00 0.00 0.02 0.00 0.00 55.36 53.82 1wfy s GLN 9 Cb -0.10 -0.94 0.00 0.00 1.00 0.00 0.00 33.01 32.97 1wfy s GLN 9 CO 0.40 -0.22 0.00 -0.85 -2.12 0.00 0.00 175.29 172.49 1wfy n GLU 10 N -0.78 0.00 0.09 2.91 0.28 -1.26 -4.90 120.64 116.99 1wfy n GLU 10 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.96 1wfy n GLU 10 Cb 0.66 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.53 1wfy n GLU 10 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 1wfy n VAL 11 N 0.00 0.00 -3.55 3.84 0.24 -1.26 -5.03 118.33 112.57 1wfy n VAL 11 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.01 1wfy n VAL 11 Cb 0.00 -0.46 -0.12 0.00 -1.47 0.00 0.00 33.84 31.79 1wfy n VAL 11 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1wfy s ARG 12 N -2.00 0.94 -0.20 7.34 1.81 -1.26 -4.98 118.95 120.60 1wfy s ARG 12 Ca 0.00 -1.78 -0.01 0.00 -1.72 0.00 0.00 55.73 52.22 1wfy s ARG 12 Cb 0.00 -1.75 0.00 0.00 -0.45 0.00 0.00 34.95 32.75 1wfy s ARG 12 CO 0.00 -1.23 0.01 1.28 -0.68 0.00 0.00 175.30 174.68 1wfy n LEU 13 N 3.57 -6.49 -3.86 2.53 4.77 -1.26 -4.98 117.00 111.28 1wfy n LEU 13 Ca 0.15 1.17 -0.30 0.00 -0.03 0.00 0.00 56.01 56.99 1wfy n LEU 13 Cb 0.38 -2.76 -0.14 0.00 -2.33 0.00 0.00 43.42 38.56 1wfy n LEU 13 CO 0.17 -2.72 -0.26 -1.61 -1.33 0.00 0.00 177.39 171.63 1wfy s GLU 14 N -1.34 1.43 0.11 3.23 2.02 -1.26 -5.09 118.70 117.80 1wfy s GLU 14 Ca -0.02 -1.99 0.05 0.00 0.02 0.00 0.00 54.97 53.03 1wfy s GLU 14 Cb 0.00 -2.77 -0.04 0.00 0.10 0.00 0.00 34.13 31.42 1wfy s GLU 14 CO 0.53 -1.06 -0.12 1.21 0.02 0.00 0.00 175.26 175.83 1wfy s ASN 15 N 0.52 1.77 -0.24 -0.19 2.47 -1.26 -4.92 114.94 113.10 1wfy s ASN 15 Ca 0.14 -0.82 -0.41 0.00 0.42 0.00 0.00 52.86 52.19 1wfy s ASN 15 Cb -0.22 -0.04 -0.19 0.00 -1.45 0.00 0.00 41.25 39.35 1wfy s ASN 15 CO -0.06 -0.20 1.27 0.54 -3.72 0.00 0.00 177.10 174.93 1wfy n ARG 16 N 0.51 0.00 -4.03 0.43 3.00 -1.26 -4.51 116.66 110.80 1wfy n ARG 16 Ca -0.15 0.00 -0.21 0.00 -0.01 0.00 0.00 57.85 57.47 1wfy n ARG 16 Cb 0.57 -1.43 -0.03 0.00 0.00 0.00 0.00 32.46 31.58 1wfy n ARG 16 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.63 178.59 1wfy s ILE 17 N 1.45 4.80 0.06 0.55 -5.25 -0.72 -4.92 121.20 117.17 1wfy s ILE 17 Ca 0.93 -1.20 0.02 0.00 -0.99 0.00 0.00 60.65 59.41 1wfy s ILE 17 Cb -1.32 -3.61 -0.03 0.00 2.95 0.00 0.00 42.46 40.45 1wfy s ILE 17 CO 0.66 -0.33 -0.07 -0.89 -1.79 0.00 0.00 174.94 172.52 1wfy s THR 18 N -2.07 0.60 0.17 8.37 2.01 -1.26 -1.79 115.64 121.68 1wfy s THR 18 Ca 0.34 -1.43 -0.16 0.00 0.31 0.00 0.00 61.69 60.75 1wfy s THR 18 Cb -0.08 -1.05 0.02 0.00 0.01 0.00 0.00 72.50 71.40 1wfy s THR 18 CO 0.27 -0.59 0.46 0.72 -0.69 0.00 0.00 174.62 174.79 1wfy s PHE 19 N -2.31 -0.06 0.29 4.92 -0.12 0.05 -4.56 117.98 116.20 1wfy s PHE 19 Ca -0.01 -0.28 0.06 0.00 -0.05 0.00 0.00 56.93 56.65 1wfy s PHE 19 Cb -0.04 0.29 -0.02 0.00 -0.63 0.00 0.00 43.02 42.62 1wfy s PHE 19 CO -0.02 -0.83 0.39 -0.65 -0.05 0.00 0.00 175.22 174.06 1wfy s GLN 20 N -3.87 3.18 0.03 1.99 -0.21 -1.26 0.96 119.66 120.47 1wfy s GLN 20 Ca 0.09 -0.95 0.03 0.00 0.02 0.00 0.00 55.36 54.54 1wfy s GLN 20 Cb 0.00 -2.79 -0.02 0.00 1.00 0.00 0.00 33.01 31.21 1wfy s GLN 20 CO -0.05 0.23 -0.08 -1.17 -2.12 0.00 0.00 175.29 172.10 1wfy s LEU 21 N -4.06 2.16 -0.36 2.90 0.20 0.35 -1.14 118.68 118.73 1wfy s LEU 21 Ca 0.40 -0.39 -0.11 0.00 0.69 0.00 0.00 54.13 54.71 1wfy s LEU 21 Cb -0.09 -0.29 0.01 0.00 -0.43 0.00 0.00 46.19 45.39 1wfy s LEU 21 CO 0.29 -0.07 0.21 -0.70 -0.29 0.00 0.00 176.35 175.79 1wfy s GLU 22 N -1.04 3.03 -1.34 1.98 2.12 0.48 -1.23 118.70 122.70 1wfy s GLU 22 Ca -0.04 -0.95 -0.13 0.00 0.36 0.00 0.00 54.97 54.21 1wfy s GLU 22 Cb -0.07 -3.74 0.10 0.00 0.26 0.00 0.00 34.13 30.68 1wfy s GLU 22 CO 0.00 -0.62 1.92 1.28 -0.54 0.00 0.00 175.26 177.31 1wfy n LEU 23 N 5.03 6.20 -4.59 2.70 4.77 -0.81 0.09 117.00 130.38 1wfy n LEU 23 Ca -0.12 -4.29 -0.52 0.00 -0.03 0.00 0.00 56.01 51.05 1wfy n LEU 23 Cb 0.47 -1.62 -0.06 0.00 -2.33 0.00 0.00 43.42 39.88 1wfy n LEU 23 CO 0.37 0.95 0.88 0.52 -1.33 0.00 0.00 177.39 178.78 1wfy n VAL 24 N 4.76 0.04 -1.07 4.08 0.31 -1.17 -3.09 118.33 122.19 1wfy n VAL 24 Ca 0.46 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.78 1wfy n VAL 24 Cb 0.40 -0.79 0.00 0.00 -0.91 0.00 0.00 33.84 32.54 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 2.47 0.56 0.00 2.92 0.00 -1.26 -4.79 105.19 105.08 1wfy n GLY 25 Ca 0.18 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1wfy n GLY 25 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1wfy n LEU 26 N -0.62 0.00 -2.29 0.99 7.94 -1.18 -5.03 117.00 116.81 1wfy n LEU 26 Ca 0.00 0.00 -0.04 0.00 -1.11 0.00 0.00 56.01 54.86 1wfy n LEU 26 Cb 0.28 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.25 1wfy n LEU 26 CO 0.00 0.00 0.08 1.21 -1.11 0.00 0.00 177.39 177.57 1wfy n GLU 27 N 0.00 -0.86 -3.73 1.96 4.07 -1.21 -5.07 120.64 115.79 1wfy n GLU 27 Ca 0.00 0.67 -0.14 0.00 -0.06 0.00 0.00 57.16 57.64 1wfy n GLU 27 Cb 0.00 -3.54 -0.14 0.00 -0.06 0.00 0.00 31.44 27.70 1wfy n GLU 27 CO 0.00 0.00 0.00 0.50 -0.06 0.00 0.00 177.13 177.57 1wfy s ARG 28 N -3.36 0.12 -0.28 5.31 3.52 -1.26 -5.05 118.95 117.96 1wfy s ARG 28 Ca 0.12 0.45 -0.11 0.00 -0.13 0.00 0.00 55.73 56.05 1wfy s ARG 28 Cb -0.02 -0.17 -0.05 0.00 -1.56 0.00 0.00 34.95 33.16 1wfy s ARG 28 CO 0.35 -0.18 0.20 0.08 -0.81 0.00 0.00 175.30 174.94 1wfy s VAL 29 N 1.34 5.31 0.26 7.11 1.01 -1.26 -1.93 120.40 132.23 1wfy s VAL 29 Ca -0.08 0.19 0.08 0.00 0.00 0.00 0.00 61.98 62.17 1wfy s VAL 29 Cb -0.11 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 1wfy s VAL 29 CO -0.07 0.25 0.12 0.68 0.00 0.00 0.00 175.10 176.08 1wfy s VAL 30 N 1.75 4.00 0.01 2.92 -7.23 -0.37 -4.89 120.40 116.59 1wfy s VAL 30 Ca 0.07 -1.62 0.07 0.00 -1.81 0.00 0.00 61.98 58.69 1wfy s VAL 30 Cb -0.16 -3.16 -0.03 0.00 0.56 0.00 0.00 36.38 33.59 1wfy s VAL 30 CO 0.11 -0.35 -0.20 -0.60 -0.31 0.00 0.00 175.10 173.74 1wfy s ARG 31 N -3.78 2.13 -0.05 4.82 3.52 -1.26 0.13 118.95 124.46 1wfy s ARG 31 Ca 0.32 -0.93 0.03 0.00 -0.13 0.00 0.00 55.73 55.03 1wfy s ARG 31 Cb -0.07 -2.16 0.00 0.00 -1.56 0.00 0.00 34.95 31.16 1wfy s ARG 31 CO 0.23 0.56 -0.13 0.42 -0.81 0.00 0.00 175.30 175.56 1wfy s ILE 32 N -0.79 1.17 -0.05 4.11 1.01 0.27 -4.96 121.20 121.96 1wfy s ILE 32 Ca 0.12 -0.55 0.06 0.00 0.00 0.00 0.00 60.65 60.28 1wfy s ILE 32 Cb -0.10 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.32 1wfy s ILE 32 CO 0.02 0.35 -0.22 -0.94 0.00 0.00 0.00 174.94 174.15 1wfy s SER 33 N 0.31 2.72 -0.19 3.58 1.04 -1.26 -0.77 113.70 119.13 1wfy s SER 33 Ca -0.08 -0.45 -0.35 0.00 0.48 0.00 0.00 55.95 55.55 1wfy s SER 33 Cb -0.12 -0.70 0.14 0.00 0.10 0.00 0.00 66.02 65.44 1wfy s SER 33 CO 0.02 0.22 1.27 0.00 0.98 0.00 0.00 173.24 175.73 1wfy s ALA 34 N -0.14 -2.14 0.68 5.32 0.00 -0.74 -5.03 121.76 119.70 1wfy s ALA 34 Ca -0.02 1.53 -0.17 0.00 0.00 0.00 0.00 51.96 53.30 1wfy s ALA 34 Cb -0.12 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 1wfy s ALA 34 CO 0.03 -0.66 0.86 0.36 0.00 0.00 0.00 175.76 176.34 1wfy n LYS 35 N -0.14 0.58 0.04 0.00 0.00 -1.26 -1.75 118.16 115.63 1wfy n LYS 35 Ca 0.00 0.25 -0.09 0.00 -0.00 0.00 0.00 58.31 58.47 1wfy n LYS 35 Cb 0.59 -2.10 -0.06 0.00 -0.00 0.00 0.00 35.03 33.45 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 -0.03 -0.20 -0.93 -1.58 0.13 -1.88 -3.34 132.00 124.18 1wfy h PRO 36 Ca -0.47 0.01 0.11 0.00 -0.87 0.00 0.00 66.00 64.78 1wfy h PRO 36 Cb 1.35 0.05 -0.13 0.00 0.13 0.00 0.00 31.00 32.40 1wfy h PRO 36 CO 0.47 0.16 -0.46 0.25 -0.23 0.00 0.00 178.00 178.20 1wfy n THR 37 N -4.90 -0.56 -0.98 1.56 -2.24 -1.26 -3.01 114.28 102.90 1wfy n THR 37 Ca -0.06 2.21 -0.36 0.00 -2.27 0.00 0.00 64.05 63.57 1wfy n THR 37 Cb 0.23 -2.82 0.05 0.00 -2.10 0.00 0.00 70.33 65.68 1wfy n THR 37 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1wfy n LYS 38 N -5.26 -0.04 -1.69 -0.78 4.81 -1.25 -4.65 118.16 109.30 1wfy n LYS 38 Ca 0.06 -0.01 -0.14 0.00 -0.87 0.00 0.00 58.31 57.34 1wfy n LYS 38 Cb 0.30 -1.08 0.08 0.00 0.02 0.00 0.00 35.03 34.36 1wfy n LYS 38 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1wfy n ARG 39 N 2.12 0.03 0.21 1.64 1.74 -1.26 -2.58 116.66 118.56 1wfy n ARG 39 Ca -0.01 -1.58 0.11 0.00 -0.77 0.00 0.00 57.85 55.60 1wfy n ARG 39 Cb 0.57 -0.46 0.24 0.00 -1.02 0.00 0.00 32.46 31.78 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 0.16 0.55 3.38 -1.42 -1.40 115.31 116.58 1wfy h LEU 40 Ca -0.21 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.41 1wfy h LEU 40 Cb 0.73 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 1wfy h LEU 40 CO 0.21 0.10 -1.83 0.06 0.09 0.00 0.00 178.44 177.08 1wfy h GLN 41 N 0.00 0.33 0.00 1.13 3.07 -1.85 -2.20 115.11 115.60 1wfy h GLN 41 Ca -0.00 -0.57 -0.06 0.00 0.09 0.00 0.00 58.65 58.11 1wfy h GLN 41 Cb 0.98 0.21 -0.01 0.00 0.08 0.00 0.00 27.48 28.74 1wfy h GLN 41 CO 0.01 1.27 -0.30 0.93 0.09 0.00 0.00 178.83 180.83 1wfy h GLU 42 N 0.05 0.00 0.00 0.06 5.08 -1.86 0.73 114.58 118.65 1wfy h GLU 42 Ca -0.38 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.76 1wfy h GLU 42 Cb 2.04 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 31.25 1wfy h GLU 42 CO 0.13 0.30 -1.45 0.00 -1.00 0.00 0.00 179.01 176.99 1wfy h ALA 43 N 1.70 0.68 -0.00 3.43 0.00 -1.37 -3.30 119.26 120.40 1wfy h ALA 43 Ca -0.00 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 53.78 1wfy h ALA 43 Cb 0.91 0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1wfy h ALA 43 CO 0.04 1.26 -0.61 1.28 0.00 0.00 0.00 179.25 181.22 1wfy n LEU 44 N -3.04 0.88 0.01 0.00 7.99 -0.82 -4.17 117.00 117.85 1wfy n LEU 44 Ca -0.11 -0.26 -0.12 0.00 -0.01 0.00 0.00 56.01 55.51 1wfy n LEU 44 Cb 0.95 -0.13 -0.07 0.00 -0.11 0.00 0.00 43.42 44.06 1wfy n LEU 44 CO 0.44 0.20 0.83 1.56 -1.51 0.00 0.00 177.39 178.91 1wfy h GLN 45 N 0.42 0.06 0.00 3.23 1.08 0.41 1.59 115.11 121.89 1wfy h GLN 45 Ca 0.00 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1wfy h GLN 45 Cb 0.53 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 1wfy h GLN 45 CO 0.00 0.16 0.00 -0.35 -0.95 0.00 0.00 178.83 177.69 1wfy n PRO 46 N -5.00 0.41 -0.10 1.46 -0.04 -1.26 -1.32 135.00 129.16 1wfy n PRO 46 Ca -0.07 0.06 -0.16 0.00 -0.04 0.00 0.00 63.50 63.29 1wfy n PRO 46 Cb 0.08 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.99 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 -1.23 1.46 -0.25 0.52 2.08 -0.71 -3.63 119.36 117.60 1wfy n ILE 47 Ca 0.12 -0.04 -0.04 0.00 0.56 0.00 0.00 62.75 63.36 1wfy n ILE 47 Cb 0.16 -2.13 0.07 0.00 -0.75 0.00 0.00 39.64 37.00 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 -0.93 0.73 -0.77 1.39 3.38 0.22 0.60 115.31 119.93 1wfy h LEU 48 Ca -0.25 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 1wfy h LEU 48 Cb 1.17 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 1wfy h LEU 48 CO -0.15 0.51 0.28 0.00 0.09 0.00 0.00 178.44 179.17 1wfy h ALA 49 N 1.29 1.00 0.00 1.53 0.00 -1.36 1.64 119.26 123.36 1wfy h ALA 49 Ca 0.28 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1wfy h ALA 49 Cb 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1wfy h ALA 49 CO -0.10 0.65 0.00 1.17 0.00 0.00 0.00 179.25 180.96 1wfy n LYS 50 N -4.28 0.57 -0.08 0.00 4.81 -0.56 -2.45 118.16 116.17 1wfy n LYS 50 Ca 0.07 0.00 0.03 0.00 -0.87 0.00 0.00 58.31 57.54 1wfy n LYS 50 Cb 0.20 -1.50 0.07 0.00 0.02 0.00 0.00 35.03 33.82 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 -1.21 0.21 -1.16 5.64 8.25 0.20 -4.95 115.22 122.20 1wfy n HIS 51 Ca 0.17 -0.52 -0.06 0.00 -0.26 0.00 0.00 57.72 57.05 1wfy n HIS 51 Cb 0.20 -0.05 -0.02 0.00 1.12 0.00 0.00 29.99 31.24 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 -0.09 0.57 0.00 -1.41 0.00 0.66 -4.94 105.19 99.99 1wfy n GLY 52 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.64 0.00 -3.54 0.99 4.77 0.53 -4.95 117.00 114.16 1wfy n LEU 53 Ca -0.06 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.81 1wfy n LEU 53 Cb 0.51 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 1wfy n LEU 53 CO 0.09 -0.18 0.34 -0.44 -1.33 0.00 0.00 177.39 175.87 1wfy s SER 54 N -1.00 -0.44 0.15 -1.43 0.01 -1.26 -4.30 113.70 105.43 1wfy s SER 54 Ca 0.00 -0.17 0.01 0.00 1.31 0.00 0.00 55.95 57.10 1wfy s SER 54 Cb 0.00 0.58 -0.06 0.00 0.21 0.00 0.00 66.02 66.75 1wfy s SER 54 CO 0.00 -0.98 1.33 -0.07 0.41 0.00 0.00 173.24 173.93 1wfy h LEU 55 N 2.10 0.30 -3.81 2.44 3.38 -1.94 -2.85 115.31 114.94 1wfy h LEU 55 Ca -0.32 -0.26 -0.53 0.00 0.09 0.00 0.00 57.88 56.86 1wfy h LEU 55 Cb 1.29 -0.09 -0.26 0.00 0.09 0.00 0.00 40.66 41.69 1wfy h LEU 55 CO 0.39 1.08 0.69 -0.67 0.09 0.00 0.00 178.44 180.02 1wfy n ASP 56 N -3.64 5.96 0.06 -0.43 -0.08 -1.26 -4.25 116.55 112.90 1wfy n ASP 56 Ca -0.04 -3.52 0.00 0.00 -1.51 0.00 0.00 54.79 49.72 1wfy n ASP 56 Cb 0.84 -0.92 0.00 0.00 2.34 0.00 0.00 41.12 43.38 1wfy n ASP 56 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1wfy n GLN 57 N -0.72 0.00 -2.04 -0.67 1.13 -1.18 -5.11 117.38 108.79 1wfy n GLN 57 Ca 0.53 0.00 -0.28 0.00 -1.94 0.00 0.00 57.00 55.31 1wfy n GLN 57 Cb 0.98 -0.11 0.12 0.00 0.11 0.00 0.00 30.24 31.33 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 -2.00 2.08 -0.02 5.09 -7.23 -1.08 -4.13 120.40 113.10 1wfy s VAL 58 Ca 0.00 -0.12 0.01 0.00 -1.81 0.00 0.00 61.98 60.06 1wfy s VAL 58 Cb 0.00 -2.96 0.01 0.00 0.56 0.00 0.00 36.38 33.99 1wfy s VAL 58 CO 0.00 0.00 -0.03 -0.69 -0.31 0.00 0.00 175.10 174.07 1wfy s VAL 59 N -3.56 0.31 -0.05 1.32 1.01 -1.15 -4.93 120.40 113.36 1wfy s VAL 59 Ca 0.66 -0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.60 1wfy s VAL 59 Cb -0.08 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.93 1wfy s VAL 59 CO 0.49 0.14 -0.09 -0.22 0.00 0.00 0.00 175.10 175.42 1wfy s LEU 60 N 0.55 3.06 -0.30 3.92 1.98 -1.26 -1.48 118.68 125.16 1wfy s LEU 60 Ca -0.06 -0.09 -0.16 0.00 -2.89 0.00 0.00 54.13 50.93 1wfy s LEU 60 Cb -0.09 -1.68 0.18 0.00 0.66 0.00 0.00 46.19 45.26 1wfy s LEU 60 CO -0.01 0.34 1.14 -1.38 -1.89 0.00 0.00 176.35 174.56 1wfy s HIS 61 N -0.83 -0.34 0.86 5.38 -3.43 -1.04 0.18 115.29 116.07 1wfy s HIS 61 Ca 0.13 0.46 -0.15 0.00 -0.80 0.00 0.00 55.06 54.70 1wfy s HIS 61 Cb -0.11 0.16 -0.05 0.00 -1.43 0.00 0.00 32.58 31.15 1wfy s HIS 61 CO 0.02 -0.18 0.10 0.54 -2.00 0.00 0.00 174.74 173.22 1wfy n ARG 62 N 5.12 -0.02 -2.31 -0.38 1.74 -1.26 -3.37 116.66 116.17 1wfy n ARG 62 Ca -0.08 0.02 -0.34 0.00 -0.77 0.00 0.00 57.85 56.69 1wfy n ARG 62 Cb 0.54 -1.57 -0.04 0.00 -1.02 0.00 0.00 32.46 30.37 1wfy n ARG 62 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1wfy s PRO 63 N -2.77 3.09 0.00 5.56 0.04 -1.26 -3.03 135.00 136.62 1wfy s PRO 63 Ca 0.55 -0.73 0.00 0.00 0.04 0.00 0.00 61.00 60.86 1wfy s PRO 63 Cb -0.26 -5.22 0.00 0.00 0.04 0.00 0.00 34.50 29.06 1wfy s PRO 63 CO 0.68 -2.79 0.00 0.41 0.04 0.00 0.00 177.00 175.34 1wfy n GLY 64 N 6.84 2.89 3.31 0.56 0.00 -1.26 -5.13 105.19 112.41 1wfy n GLY 64 Ca 0.37 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.09 -2.98 1.61 -0.58 -1.17 -4.95 120.64 111.48 1wfy n GLU 65 Ca 0.00 -0.29 -0.24 0.00 -0.42 0.00 0.00 57.16 56.21 1wfy n GLU 65 Cb 0.00 -1.73 -0.03 0.00 -0.57 0.00 0.00 31.44 29.11 1wfy n GLU 65 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 1wfy n LYS 66 N -1.76 2.57 0.00 3.49 -0.00 -1.26 -4.93 118.16 116.27 1wfy n LYS 66 Ca 0.03 -4.40 0.00 0.00 -0.00 0.00 0.00 58.31 53.94 1wfy n LYS 66 Cb 0.59 -2.07 0.00 0.00 -0.00 0.00 0.00 35.03 33.55 1wfy n LYS 66 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1wfy n GLN 67 N -0.11 0.00 -2.33 -1.58 6.02 -1.26 -5.10 117.38 113.02 1wfy n GLN 67 Ca 0.29 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.86 1wfy n GLN 67 Cb 0.49 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.72 1wfy n GLN 67 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1wfy s PRO 68 N -2.00 3.32 -0.65 -1.09 0.04 -1.26 -4.59 135.00 128.77 1wfy s PRO 68 Ca 0.00 0.64 -0.26 0.00 0.04 0.00 0.00 61.00 61.43 1wfy s PRO 68 Cb 0.00 -4.13 -0.11 0.00 0.04 0.00 0.00 34.50 30.30 1wfy s PRO 68 CO 0.00 -1.91 2.42 -1.33 0.04 0.00 0.00 177.00 176.23 1wfy n MET 69 N 8.55 0.77 -1.24 4.56 2.81 0.47 -4.87 117.12 128.17 1wfy n MET 69 Ca 0.15 -0.34 -0.39 0.00 -1.81 0.00 0.00 57.70 55.31 1wfy n MET 69 Cb 0.49 -3.38 0.01 0.00 -0.71 0.00 0.00 33.22 29.63 1wfy n MET 69 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1wfy n ASP 70 N 16.48 -3.73 -1.99 7.83 8.00 -1.26 -4.64 116.55 137.25 1wfy n ASP 70 Ca 0.43 0.63 -0.21 0.00 0.71 0.00 0.00 54.79 56.35 1wfy n ASP 70 Cb 0.46 -0.85 0.08 0.00 -0.02 0.00 0.00 41.12 40.79 1wfy n ASP 70 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1wfy n LEU 71 N 2.50 6.49 -0.06 0.64 4.77 -1.26 -4.08 117.00 126.00 1wfy n LEU 71 Ca 0.07 -3.44 -0.10 0.00 -0.03 0.00 0.00 56.01 52.51 1wfy n LEU 71 Cb 0.48 -0.93 -0.15 0.00 -2.33 0.00 0.00 43.42 40.49 1wfy n LEU 71 CO 0.54 1.17 -0.83 -0.62 -1.33 0.00 0.00 177.39 176.32 1wfy n GLU 72 N -0.32 0.66 -2.49 3.23 1.02 -1.26 -3.17 120.64 118.32 1wfy n GLU 72 Ca 0.42 0.17 -0.35 0.00 -0.02 0.00 0.00 57.16 57.38 1wfy n GLU 72 Cb 0.85 -1.67 -0.03 0.00 -0.02 0.00 0.00 31.44 30.57 1wfy n GLU 72 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1wfy s ASN 73 N -5.94 6.30 0.31 1.62 0.01 -1.26 -4.74 114.94 111.25 1wfy s ASN 73 Ca -0.09 2.00 -0.28 0.00 -0.71 0.00 0.00 52.86 53.78 1wfy s ASN 73 Cb 0.07 -2.57 -0.09 0.00 0.41 0.00 0.00 41.25 39.07 1wfy s ASN 73 CO 0.81 -0.81 1.07 -2.16 -1.51 0.00 0.00 177.10 174.50 1wfy s PRO 74 N -3.11 4.51 0.64 -0.60 0.04 -1.26 -2.10 135.00 133.12 1wfy s PRO 74 Ca 0.67 1.69 0.27 0.00 0.04 0.00 0.00 61.00 63.67 1wfy s PRO 74 Cb -0.19 -3.00 1.42 0.00 0.04 0.00 0.00 34.50 32.77 1wfy s PRO 74 CO 0.23 0.13 1.82 -0.39 0.04 0.00 0.00 177.00 178.82 1wfy h VAL 75 N 2.82 0.14 -0.79 -0.36 -1.51 -1.40 0.36 116.25 115.51 1wfy h VAL 75 Ca -0.47 0.00 0.20 0.00 -1.23 0.00 0.00 66.70 65.19 1wfy h VAL 75 Cb 1.21 0.57 -0.05 0.00 -2.13 0.00 0.00 31.29 30.90 1wfy h VAL 75 CO 0.66 0.00 0.54 0.77 -1.23 0.00 0.00 177.57 178.31 1wfy h SER 76 N 0.00 0.22 0.27 4.19 4.64 -1.80 0.15 113.55 121.21 1wfy h SER 76 Ca 0.10 0.02 -0.32 0.00 -0.47 0.00 0.00 61.79 61.11 1wfy h SER 76 Cb 1.04 -0.02 0.03 0.00 -0.31 0.00 0.00 62.40 63.14 1wfy h SER 76 CO -0.00 0.10 -1.41 0.28 -0.87 0.00 0.00 176.83 174.93 1wfy h SER 77 N 0.22 0.82 -0.63 4.97 0.02 -0.62 -3.27 113.55 115.07 1wfy h SER 77 Ca 0.39 -0.85 -0.37 0.00 -0.84 0.00 0.00 61.79 60.12 1wfy h SER 77 Cb 1.20 -0.26 -0.15 0.00 0.14 0.00 0.00 62.40 63.33 1wfy h SER 77 CO -0.09 1.66 0.39 1.33 -1.14 0.00 0.00 176.83 178.98 1wfy n VAL 78 N -3.72 2.94 -2.85 2.27 0.24 0.44 -4.37 118.33 113.29 1wfy n VAL 78 Ca -0.15 -2.03 -0.22 0.00 -2.04 0.00 0.00 64.34 59.89 1wfy n VAL 78 Cb 1.07 -1.43 -0.02 0.00 -1.47 0.00 0.00 33.84 31.99 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 0.55 3.96 0.15 2.33 0.00 -0.79 -4.56 120.51 122.15 1wfy n ALA 79 Ca 0.36 -4.09 0.00 0.00 0.00 0.00 0.00 53.44 49.71 1wfy n ALA 79 Cb 0.58 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1wfy n ALA 79 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wfy n SER 80 N -0.15 -1.82 -3.14 0.00 2.88 -1.26 -4.90 113.62 105.22 1wfy n SER 80 Ca 0.28 0.56 -0.09 0.00 -1.33 0.00 0.00 58.87 58.29 1wfy n SER 80 Cb 0.58 1.84 0.01 0.00 -0.75 0.00 0.00 64.21 65.88 1wfy n SER 80 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wfy n GLN 81 N -3.25 1.02 -3.66 -1.46 6.02 -1.26 -5.02 117.38 109.77 1wfy n GLN 81 Ca 0.00 -1.30 -0.38 0.00 -0.01 0.00 0.00 57.00 55.31 1wfy n GLN 81 Cb 0.00 0.03 -0.06 0.00 1.02 0.00 0.00 30.24 31.23 1wfy n GLN 81 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1wfy s THR 82 N -0.77 5.23 0.44 5.09 2.01 -1.26 -4.23 115.64 122.15 1wfy s THR 82 Ca 0.18 0.57 0.05 0.00 0.31 0.00 0.00 61.69 62.80 1wfy s THR 82 Cb -0.01 -3.58 0.01 0.00 0.01 0.00 0.00 72.50 68.93 1wfy s THR 82 CO 0.11 0.59 0.61 -0.76 -0.69 0.00 0.00 174.62 174.49 1wfy s LEU 83 N -1.03 3.61 -0.04 4.42 1.43 -0.29 -4.14 118.68 122.65 1wfy s LEU 83 Ca 0.20 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 53.12 1wfy s LEU 83 Cb -0.15 -2.77 -0.00 0.00 0.03 0.00 0.00 46.19 43.30 1wfy s LEU 83 CO 0.09 -0.80 -0.17 -0.69 0.23 0.00 0.00 176.35 175.02 1wfy s VAL 84 N -2.44 1.41 -0.06 -1.59 1.01 -1.22 0.18 120.40 117.69 1wfy s VAL 84 Ca 0.53 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.84 1wfy s VAL 84 Cb -0.10 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 1wfy s VAL 84 CO 0.34 0.41 -0.16 -0.22 0.00 0.00 0.00 175.10 175.48 1wfy s LEU 85 N 0.04 2.64 -0.48 3.92 1.98 0.11 -2.51 118.68 124.38 1wfy s LEU 85 Ca -0.04 -0.26 0.03 0.00 -2.89 0.00 0.00 54.13 50.98 1wfy s LEU 85 Cb -0.11 -1.54 0.13 0.00 0.66 0.00 0.00 46.19 45.33 1wfy s LEU 85 CO 0.02 0.30 0.24 -0.62 -1.89 0.00 0.00 176.35 174.40 1wfy s ASP 86 N -0.48 4.15 0.84 3.68 -1.08 -0.55 -3.04 116.67 120.20 1wfy s ASP 86 Ca 0.06 -2.83 -0.13 0.00 -0.52 0.00 0.00 52.55 49.13 1wfy s ASP 86 Cb -0.12 -1.46 0.07 0.00 -1.46 0.00 0.00 42.92 39.95 1wfy s ASP 86 CO 0.02 -0.25 0.96 0.35 0.52 0.00 0.00 175.17 176.77 1wfy n THR 87 N 3.33 1.30 -1.57 1.71 -2.24 -1.26 -2.91 114.28 112.64 1wfy n THR 87 Ca 0.06 -0.19 -0.31 0.00 -2.27 0.00 0.00 64.05 61.34 1wfy n THR 87 Cb 0.33 -1.00 0.06 0.00 -2.10 0.00 0.00 70.33 67.62 1wfy n THR 87 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1wfy s PRO 88 N -3.93 2.71 -0.81 -0.78 0.04 -1.26 -4.90 135.00 126.07 1wfy s PRO 88 Ca 0.68 0.87 -0.07 0.00 0.04 0.00 0.00 61.00 62.53 1wfy s PRO 88 Cb -0.27 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.18 1wfy s PRO 88 CO 0.56 -1.24 2.61 -0.35 0.04 0.00 0.00 177.00 178.62 1wfy n PRO 89 N -3.21 2.35 0.00 0.56 -0.04 -1.26 -2.97 135.00 130.43 1wfy n PRO 89 Ca 0.07 -1.43 0.00 0.00 -0.04 0.00 0.00 63.50 62.10 1wfy n PRO 89 Cb 0.54 -2.36 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 1wfy n PRO 89 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1wfy n ASP 90 N 3.49 0.00 0.00 3.54 5.75 -1.26 -4.92 116.55 123.15 1wfy n ASP 90 Ca 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.28 1wfy n ASP 90 Cb 0.35 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 1wfy n ASP 90 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wfy n ALA 91 N 0.00 0.00 0.17 2.12 0.00 -1.16 -2.98 120.51 118.66 1wfy n ALA 91 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wfy n ALA 91 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1wfy n ALA 91 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1wfy n LYS 92 N 0.00 0.00 -1.35 0.00 3.00 -1.26 -4.94 118.16 113.62 1wfy n LYS 92 Ca 0.00 0.00 -0.50 0.00 -0.00 0.00 0.00 58.31 57.81 1wfy n LYS 92 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 34.98 1wfy n LYS 92 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.40 176.07 1wfy n MET 93 N -3.36 0.00 -0.55 1.64 2.81 -1.16 -4.86 117.12 111.64 1wfy n MET 93 Ca 0.00 0.00 -0.19 0.00 -1.81 0.00 0.00 57.70 55.70 1wfy n MET 93 Cb 0.00 -1.19 0.14 0.00 -0.71 0.00 0.00 33.22 31.46 1wfy n MET 93 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1wfy n SER 94 N 1.58 -2.96 -4.08 7.83 2.88 -1.26 -4.82 113.62 112.80 1wfy n SER 94 Ca 0.18 -0.36 -0.36 0.00 -1.33 0.00 0.00 58.87 57.00 1wfy n SER 94 Cb 0.14 -0.76 0.06 0.00 -0.75 0.00 0.00 64.21 62.89 1wfy n SER 94 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1wfy n GLU 95 N -1.62 -0.08 -0.61 -1.46 0.28 -1.26 -4.63 120.64 111.25 1wfy n GLU 95 Ca 0.05 -0.02 0.08 0.00 -0.16 0.00 0.00 57.16 57.12 1wfy n GLU 95 Cb 0.36 -1.17 -0.02 0.00 1.43 0.00 0.00 31.44 32.05 1wfy n GLU 95 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1wfy n ALA 96 N -2.81 -1.58 -0.61 -1.84 0.00 -1.26 -5.03 120.51 107.38 1wfy n ALA 96 Ca -0.00 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1wfy n ALA 96 Cb 0.57 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.48 1wfy n ALA 96 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1wfy n ARG 97 N -2.92 -1.71 0.00 0.00 0.63 -1.26 -4.68 116.66 106.72 1wfy n ARG 97 Ca 0.00 1.29 0.00 0.00 -0.92 0.00 0.00 57.85 58.22 1wfy n ARG 97 Cb 0.28 -1.51 0.00 0.00 0.45 0.00 0.00 32.46 31.68 1wfy n ARG 97 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1wfy n SER 98 N -1.31 0.00 -0.33 6.15 2.88 -1.26 -4.90 113.62 114.85 1wfy n SER 98 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1wfy n SER 98 Cb 0.07 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.53 1wfy n SER 98 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wfy n SER 99 N 2.00 -1.99 -2.05 -3.46 7.64 -1.26 -5.04 113.62 109.45 1wfy n SER 99 Ca 0.00 0.02 -0.02 0.00 1.01 0.00 0.00 58.87 59.88 1wfy n SER 99 Cb 0.00 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 1wfy n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wfy n GLY 100 N -0.08 -1.61 0.08 0.23 0.00 -1.26 -4.96 105.19 97.58 1wfy n GLY 100 Ca 0.00 0.36 -0.14 0.00 0.00 0.00 0.00 46.02 46.24 1wfy n GLY 100 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wfy h PRO 101 N 0.96 0.07 -2.43 1.61 0.13 -1.96 -3.46 132.00 126.91 1wfy h PRO 101 Ca 0.00 -0.06 0.16 0.00 -0.87 0.00 0.00 66.00 65.23 1wfy h PRO 101 Cb 0.31 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 31.39 1wfy h PRO 101 CO 0.07 0.80 0.49 -1.54 -0.23 0.00 0.00 178.00 177.60 1wfy s SER 102 N -6.08 -0.12 0.31 1.44 1.04 -1.26 -4.75 113.70 104.29 1wfy s SER 102 Ca -0.17 -0.52 -0.29 0.00 0.48 0.00 0.00 55.95 55.45 1wfy s SER 102 Cb -0.00 0.52 -0.10 0.00 0.10 0.00 0.00 66.02 66.53 1wfy s SER 102 CO 0.70 -0.98 1.33 -0.55 0.98 0.00 0.00 173.24 174.72 1wfy s SER 103 N -3.06 6.76 0.00 7.02 0.15 -1.26 -5.26 113.70 118.04 1wfy s SER 103 Ca 0.15 2.67 0.00 0.00 0.70 0.00 0.00 55.95 59.47 1wfy s SER 103 Cb -0.02 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.65 1wfy s SER 103 CO 0.04 -0.56 0.00 0.61 1.20 0.00 0.00 173.24 174.52