#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wfy n SER 2 N 0.00 0.00 0.21 1.61 7.64 -1.26 -3.56 113.62 118.26 1wfy n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1wfy n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1wfy n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wfy n SER 3 N 1.55 -3.76 -2.43 6.43 2.88 -1.26 -5.12 113.62 111.91 1wfy n SER 3 Ca 0.00 0.85 -0.01 0.00 -1.33 0.00 0.00 58.87 58.38 1wfy n SER 3 Cb 0.00 3.54 0.00 0.00 -0.75 0.00 0.00 64.21 67.00 1wfy n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wfy n GLY 4 N -1.45 -3.72 3.29 0.46 0.00 -1.23 -5.08 105.19 97.45 1wfy n GLY 4 Ca 0.00 0.35 0.03 0.00 0.00 0.00 0.00 46.02 46.40 1wfy n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wfy s SER 5 N -1.33 -0.57 -0.06 1.61 0.15 -1.26 -5.12 113.70 107.12 1wfy s SER 5 Ca 0.02 0.60 -0.32 0.00 0.70 0.00 0.00 55.95 56.95 1wfy s SER 5 Cb -0.00 1.58 0.13 0.00 -1.71 0.00 0.00 66.02 66.01 1wfy s SER 5 CO 0.60 -0.11 1.30 -0.55 1.20 0.00 0.00 173.24 175.68 1wfy s SER 6 N 2.63 -0.06 1.13 5.45 0.15 -1.26 -5.17 113.70 116.57 1wfy s SER 6 Ca -0.00 -0.09 -0.16 0.00 0.70 0.00 0.00 55.95 56.40 1wfy s SER 6 Cb -0.08 0.13 0.24 0.00 -1.71 0.00 0.00 66.02 64.60 1wfy s SER 6 CO -0.16 -0.24 0.54 0.61 1.20 0.00 0.00 173.24 175.20 1wfy n GLY 7 N -0.42 -2.87 0.00 9.45 0.00 -1.26 -4.90 105.19 105.20 1wfy n GLY 7 Ca -0.07 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1wfy n GLY 7 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wfy n ASP 8 N -2.58 0.00 0.00 1.61 5.75 -1.26 -5.15 116.55 114.92 1wfy n ASP 8 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.87 1wfy n ASP 8 Cb 0.39 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.48 1wfy n ASP 8 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wfy n GLN 9 N 0.00 -2.18 0.00 0.11 10.64 -1.26 -5.06 117.38 119.63 1wfy n GLN 9 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1wfy n GLN 9 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 1wfy n GLN 9 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 1wfy n GLU 10 N -0.02 0.00 0.00 2.61 0.28 -1.26 -5.04 120.64 117.21 1wfy n GLU 10 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1wfy n GLU 10 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1wfy n GLU 10 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1wfy n VAL 11 N 0.00 0.00 -4.82 3.84 0.31 -1.26 -4.55 118.33 111.84 1wfy n VAL 11 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.02 1wfy n VAL 11 Cb 0.00 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 32.79 1wfy n VAL 11 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wfy s ARG 12 N 0.00 1.96 0.85 5.55 1.70 -1.26 -5.10 118.95 122.65 1wfy s ARG 12 Ca 0.00 -1.03 -0.17 0.00 -0.47 0.00 0.00 55.73 54.06 1wfy s ARG 12 Cb 0.00 -2.09 -0.13 0.00 -0.57 0.00 0.00 34.95 32.17 1wfy s ARG 12 CO 0.00 0.53 -0.42 1.28 -1.08 0.00 0.00 175.30 175.61 1wfy n LEU 13 N 1.74 -4.39 -4.92 -1.89 4.77 -1.26 -4.95 117.00 106.11 1wfy n LEU 13 Ca -0.17 0.35 -0.29 0.00 -0.03 0.00 0.00 56.01 55.87 1wfy n LEU 13 Cb 0.52 -0.86 -0.04 0.00 -2.33 0.00 0.00 43.42 40.71 1wfy n LEU 13 CO 0.25 -5.29 -0.14 -0.70 -1.33 0.00 0.00 177.39 170.18 1wfy s GLU 14 N -1.95 3.41 1.14 3.23 2.12 -1.26 -5.10 118.70 120.29 1wfy s GLU 14 Ca 0.48 -0.51 -0.18 0.00 0.36 0.00 0.00 54.97 55.12 1wfy s GLU 14 Cb -0.28 -2.99 0.27 0.00 0.26 0.00 0.00 34.13 31.39 1wfy s GLU 14 CO 0.75 0.58 0.62 -1.71 -0.54 0.00 0.00 175.26 174.96 1wfy n ASN 15 N 0.01 -3.53 -4.28 -1.70 5.15 -1.26 -4.68 115.26 104.96 1wfy n ASN 15 Ca -0.06 -0.63 -0.57 0.00 -0.60 0.00 0.00 54.58 52.73 1wfy n ASN 15 Cb 0.52 -0.80 -0.08 0.00 -0.53 0.00 0.00 39.78 38.90 1wfy n ASN 15 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1wfy n ARG 16 N -3.84 0.00 -3.92 1.20 3.00 -1.26 -4.62 116.66 107.22 1wfy n ARG 16 Ca 0.10 0.00 -0.21 0.00 -0.01 0.00 0.00 57.85 57.73 1wfy n ARG 16 Cb 0.43 -1.41 -0.02 0.00 0.00 0.00 0.00 32.46 31.45 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 0.44 4.79 0.05 0.55 -5.25 -0.52 -4.91 121.20 116.35 1wfy s ILE 17 Ca 0.88 -1.11 -0.01 0.00 -0.99 0.00 0.00 60.65 59.42 1wfy s ILE 17 Cb -1.23 -3.65 -0.04 0.00 2.95 0.00 0.00 42.46 40.50 1wfy s ILE 17 CO 0.57 -0.30 -0.02 -0.89 -1.79 0.00 0.00 174.94 172.51 1wfy s THR 18 N -2.06 0.20 0.15 8.37 2.01 -1.26 -1.55 115.64 121.49 1wfy s THR 18 Ca 0.36 -1.65 -0.17 0.00 0.31 0.00 0.00 61.69 60.54 1wfy s THR 18 Cb -0.09 -1.32 0.03 0.00 0.01 0.00 0.00 72.50 71.14 1wfy s THR 18 CO 0.28 -0.91 0.45 0.72 -0.69 0.00 0.00 174.62 174.47 1wfy s PHE 19 N -3.53 -0.18 0.18 4.92 -0.12 -0.22 -4.18 117.98 114.85 1wfy s PHE 19 Ca 0.03 -0.13 0.04 0.00 -0.05 0.00 0.00 56.93 56.82 1wfy s PHE 19 Cb 0.05 0.31 -0.03 0.00 -0.63 0.00 0.00 43.02 42.72 1wfy s PHE 19 CO -0.09 -0.78 0.30 -0.65 -0.05 0.00 0.00 175.22 173.95 1wfy s GLN 20 N -3.83 3.38 0.00 1.99 1.11 -1.25 0.58 119.66 121.65 1wfy s GLN 20 Ca 0.05 -0.69 0.02 0.00 0.01 0.00 0.00 55.36 54.76 1wfy s GLN 20 Cb 0.01 -2.90 -0.01 0.00 -1.01 0.00 0.00 33.01 29.10 1wfy s GLN 20 CO -0.09 0.48 -0.08 -1.17 0.01 0.00 0.00 175.29 174.44 1wfy s LEU 21 N -3.50 2.05 -0.42 2.90 0.20 0.51 -0.47 118.68 119.95 1wfy s LEU 21 Ca 0.34 -0.21 -0.16 0.00 0.69 0.00 0.00 54.13 54.80 1wfy s LEU 21 Cb -0.10 -0.38 0.03 0.00 -0.43 0.00 0.00 46.19 45.31 1wfy s LEU 21 CO 0.28 0.05 0.34 -0.70 -0.29 0.00 0.00 176.35 176.04 1wfy s GLU 22 N -0.41 3.00 -1.37 1.98 2.12 0.24 -0.17 118.70 124.08 1wfy s GLU 22 Ca 0.01 -1.00 -0.16 0.00 0.36 0.00 0.00 54.97 54.19 1wfy s GLU 22 Cb -0.04 -3.99 0.03 0.00 0.26 0.00 0.00 34.13 30.39 1wfy s GLU 22 CO -0.00 -0.80 2.11 1.28 -0.54 0.00 0.00 175.26 177.30 1wfy n LEU 23 N 5.27 6.22 -4.54 2.70 4.77 -0.75 -1.05 117.00 129.62 1wfy n LEU 23 Ca -0.10 -3.99 -0.53 0.00 -0.03 0.00 0.00 56.01 51.35 1wfy n LEU 23 Cb 0.47 -1.64 -0.06 0.00 -2.33 0.00 0.00 43.42 39.86 1wfy n LEU 23 CO 0.43 0.76 0.65 0.52 -1.33 0.00 0.00 177.39 178.42 1wfy n VAL 24 N 5.47 0.41 0.00 4.08 0.31 -1.22 -0.17 118.33 127.21 1wfy n VAL 24 Ca 0.51 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.74 1wfy n VAL 24 Cb 0.41 -0.44 0.00 0.00 -0.91 0.00 0.00 33.84 32.89 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 1.97 2.51 0.10 2.92 0.00 -1.26 -4.66 105.19 106.77 1wfy n GLY 25 Ca 0.18 -0.57 -0.04 0.00 0.00 0.00 0.00 46.02 45.60 1wfy n GLY 25 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1wfy h LEU 26 N 0.00 0.00 -2.50 0.99 6.46 -0.97 -3.49 115.31 115.80 1wfy h LEU 26 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1wfy h LEU 26 Cb 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.93 1wfy h LEU 26 CO 0.00 0.79 -0.18 -0.62 -0.62 0.00 0.00 178.44 177.81 1wfy n GLU 27 N -3.58 -1.37 -3.64 1.25 -0.58 -0.40 -5.06 120.64 107.26 1wfy n GLU 27 Ca -0.01 1.47 -0.04 0.00 -0.42 0.00 0.00 57.16 58.16 1wfy n GLU 27 Cb 0.77 -4.65 -0.07 0.00 -0.57 0.00 0.00 31.44 26.92 1wfy n GLU 27 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1wfy s ARG 28 N -2.61 0.29 -0.37 3.49 1.70 -1.26 -5.02 118.95 115.18 1wfy s ARG 28 Ca 0.09 0.40 -0.17 0.00 -0.47 0.00 0.00 55.73 55.58 1wfy s ARG 28 Cb -0.03 0.11 0.00 0.00 -0.57 0.00 0.00 34.95 34.47 1wfy s ARG 28 CO 0.56 -0.04 0.46 0.08 -1.08 0.00 0.00 175.30 175.28 1wfy s VAL 29 N 0.54 5.06 0.25 4.99 1.01 -1.26 -1.82 120.40 129.17 1wfy s VAL 29 Ca -0.00 0.11 0.05 0.00 0.00 0.00 0.00 61.98 62.14 1wfy s VAL 29 Cb -0.04 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 1wfy s VAL 29 CO -0.11 -0.24 0.33 0.68 0.00 0.00 0.00 175.10 175.76 1wfy s VAL 30 N 2.26 5.06 0.02 2.92 -7.23 0.76 -4.86 120.40 119.33 1wfy s VAL 30 Ca 0.16 -1.07 0.08 0.00 -1.81 0.00 0.00 61.98 59.33 1wfy s VAL 30 Cb -0.16 -3.75 -0.02 0.00 0.56 0.00 0.00 36.38 33.00 1wfy s VAL 30 CO 0.13 -0.33 -0.23 -0.60 -0.31 0.00 0.00 175.10 173.76 1wfy s ARG 31 N -3.96 1.71 -0.06 4.82 6.06 -1.26 0.19 118.95 126.45 1wfy s ARG 31 Ca 0.34 -0.94 0.03 0.00 -2.50 0.00 0.00 55.73 52.67 1wfy s ARG 31 Cb -0.09 -1.77 0.00 0.00 0.06 0.00 0.00 34.95 33.16 1wfy s ARG 31 CO 0.28 0.47 -0.17 0.42 -2.50 0.00 0.00 175.30 173.80 1wfy s ILE 32 N -0.69 1.47 -0.08 4.11 1.01 0.20 -4.96 121.20 122.26 1wfy s ILE 32 Ca 0.09 -0.70 0.05 0.00 0.00 0.00 0.00 60.65 60.09 1wfy s ILE 32 Cb -0.09 -1.29 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 1wfy s ILE 32 CO 0.01 0.43 -0.24 -0.94 0.00 0.00 0.00 174.94 174.20 1wfy s SER 33 N 0.34 3.15 -0.14 3.58 1.04 -1.26 -1.06 113.70 119.35 1wfy s SER 33 Ca -0.11 -0.52 -0.34 0.00 0.48 0.00 0.00 55.95 55.46 1wfy s SER 33 Cb -0.15 -1.16 0.13 0.00 0.10 0.00 0.00 66.02 64.94 1wfy s SER 33 CO 0.04 0.20 1.17 0.00 0.98 0.00 0.00 173.24 175.63 1wfy s ALA 34 N 0.09 -2.05 0.72 5.32 0.00 -0.60 -5.03 121.76 120.23 1wfy s ALA 34 Ca -0.11 1.38 -0.16 0.00 0.00 0.00 0.00 51.96 53.07 1wfy s ALA 34 Cb -0.16 0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.01 1wfy s ALA 34 CO 0.06 -0.67 1.07 0.36 0.00 0.00 0.00 175.76 176.58 1wfy n LYS 35 N -0.17 0.56 0.07 0.00 0.00 -1.26 -1.44 118.16 115.93 1wfy n LYS 35 Ca -0.02 0.25 -0.07 0.00 -0.00 0.00 0.00 58.31 58.48 1wfy n LYS 35 Cb 0.59 -2.32 -0.04 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 -0.23 -0.28 -0.86 -1.58 0.13 -1.83 -3.33 132.00 124.03 1wfy h PRO 36 Ca -0.48 0.02 0.14 0.00 -0.87 0.00 0.00 66.00 64.81 1wfy h PRO 36 Cb 1.33 0.06 -0.14 0.00 0.13 0.00 0.00 31.00 32.38 1wfy h PRO 36 CO 0.48 -0.06 -0.32 0.25 -0.23 0.00 0.00 178.00 178.12 1wfy n THR 37 N -4.96 -0.44 -0.91 1.56 -2.24 -1.26 -2.92 114.28 103.11 1wfy n THR 37 Ca -0.05 2.00 -0.36 0.00 -2.27 0.00 0.00 64.05 63.37 1wfy n THR 37 Cb 0.17 -2.66 0.07 0.00 -2.10 0.00 0.00 70.33 65.82 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 -5.28 -0.32 -1.87 -0.78 4.81 -1.25 -4.66 118.16 108.81 1wfy n LYS 38 Ca 0.09 -0.08 -0.17 0.00 -0.87 0.00 0.00 58.31 57.28 1wfy n LYS 38 Cb 0.35 -1.25 0.10 0.00 0.02 0.00 0.00 35.03 34.25 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 1.10 -0.09 0.08 1.64 1.74 -1.26 -2.57 116.66 117.29 1wfy n ARG 39 Ca -0.00 -1.83 -0.03 0.00 -0.77 0.00 0.00 57.85 55.22 1wfy n ARG 39 Cb 0.64 -0.56 -0.06 0.00 -1.02 0.00 0.00 32.46 31.45 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 0.07 0.55 3.38 0.75 -2.48 115.31 117.58 1wfy h LEU 40 Ca -0.25 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.42 1wfy h LEU 40 Cb 0.86 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1wfy h LEU 40 CO 0.24 0.76 -1.61 0.06 0.09 0.00 0.00 178.44 177.98 1wfy h GLN 41 N 0.00 0.15 0.00 1.13 3.07 -1.84 -2.60 115.11 115.01 1wfy h GLN 41 Ca -0.06 -0.25 -0.11 0.00 0.09 0.00 0.00 58.65 58.32 1wfy h GLN 41 Cb 1.63 0.09 -0.02 0.00 0.08 0.00 0.00 27.48 29.27 1wfy h GLN 41 CO 0.09 0.92 -0.50 0.93 0.09 0.00 0.00 178.83 180.35 1wfy h GLU 42 N 0.04 0.00 0.00 0.06 4.39 -1.89 0.40 114.58 117.57 1wfy h GLU 42 Ca -0.26 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.37 1wfy h GLU 42 Cb 1.99 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.63 1wfy h GLU 42 CO 0.12 0.50 -0.88 0.00 -1.16 0.00 0.00 179.01 177.60 1wfy h ALA 43 N 1.50 0.65 0.00 3.43 0.00 -1.54 -3.26 119.26 120.04 1wfy h ALA 43 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1wfy h ALA 43 Cb 1.06 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1wfy h ALA 43 CO 0.07 0.37 -1.03 1.28 0.00 0.00 0.00 179.25 179.93 1wfy n LEU 44 N -2.90 0.61 -0.03 0.00 7.99 -0.98 -4.19 117.00 117.51 1wfy n LEU 44 Ca -0.02 0.03 -0.09 0.00 -0.01 0.00 0.00 56.01 55.92 1wfy n LEU 44 Cb 0.66 -0.10 -0.03 0.00 -0.11 0.00 0.00 43.42 43.85 1wfy n LEU 44 CO 0.40 0.02 0.81 1.56 -1.51 0.00 0.00 177.39 178.67 1wfy h GLN 45 N 0.00 -0.05 0.00 3.23 1.08 -0.26 1.59 115.11 120.70 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 0.76 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.20 1wfy h GLN 45 CO 0.00 -0.04 0.00 -0.35 -0.95 0.00 0.00 178.83 177.49 1wfy n PRO 46 N -5.22 0.53 -0.14 1.46 -0.04 -1.26 -1.89 135.00 128.44 1wfy n PRO 46 Ca -0.03 0.04 -0.29 0.00 -0.04 0.00 0.00 63.50 63.18 1wfy n PRO 46 Cb 0.15 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.01 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 0.37 0.52 2.08 0.29 -3.84 119.36 119.12 1wfy n ILE 47 Ca 0.14 -0.38 -0.18 0.00 0.56 0.00 0.00 62.75 62.89 1wfy n ILE 47 Cb 0.13 -1.86 -0.09 0.00 -0.75 0.00 0.00 39.64 37.07 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 -0.95 -0.76 -0.54 1.39 3.38 0.22 0.62 115.31 118.66 1wfy h LEU 48 Ca -0.69 0.01 0.11 0.00 0.09 0.00 0.00 57.88 57.41 1wfy h LEU 48 Cb 1.61 0.20 -0.10 0.00 0.09 0.00 0.00 40.66 42.46 1wfy h LEU 48 CO -0.41 -0.52 -0.11 0.00 0.09 0.00 0.00 178.44 177.49 1wfy h ALA 49 N -0.63 0.40 -0.57 1.53 0.00 -1.50 1.90 119.26 120.40 1wfy h ALA 49 Ca -0.09 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1wfy h ALA 49 Cb 0.70 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1wfy h ALA 49 CO 0.15 -0.43 0.26 -0.22 0.00 0.00 0.00 179.25 179.01 1wfy h LYS 50 N 0.02 0.80 -0.24 0.00 3.64 -1.61 0.12 116.57 119.31 1wfy h LYS 50 Ca 0.27 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1wfy h LYS 50 Cb 0.41 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1wfy h LYS 50 CO -0.54 0.63 0.00 0.72 -2.27 0.00 0.00 179.45 177.99 1wfy n HIS 51 N -4.36 0.32 -1.86 1.91 8.25 0.21 -4.87 115.22 114.83 1wfy n HIS 51 Ca 0.05 -0.16 -0.21 0.00 -0.26 0.00 0.00 57.72 57.14 1wfy n HIS 51 Cb 0.14 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.18 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 1.02 1.21 0.00 -1.41 0.00 0.53 -4.96 105.19 101.58 1wfy n GLY 52 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.58 0.00 -4.14 0.99 4.77 0.50 -4.92 117.00 111.62 1wfy n LEU 53 Ca -0.22 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.63 1wfy n LEU 53 Cb 0.69 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.70 1wfy n LEU 53 CO 0.31 -0.40 -0.05 -0.44 -1.33 0.00 0.00 177.39 175.48 1wfy s SER 54 N -1.00 0.45 0.10 -1.43 0.01 -1.26 -3.94 113.70 106.63 1wfy s SER 54 Ca 0.00 -1.35 0.14 0.00 1.31 0.00 0.00 55.95 56.05 1wfy s SER 54 Cb 0.00 0.51 -0.13 0.00 0.21 0.00 0.00 66.02 66.61 1wfy s SER 54 CO 0.00 -1.03 1.01 -0.07 0.41 0.00 0.00 173.24 173.56 1wfy h LEU 55 N 2.37 0.00 -4.00 2.44 3.38 -1.96 -3.20 115.31 114.34 1wfy h LEU 55 Ca -0.30 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.13 1wfy h LEU 55 Cb 1.25 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.69 1wfy h LEU 55 CO 0.44 0.73 0.67 -0.67 0.09 0.00 0.00 178.44 179.70 1wfy n ASP 56 N -3.08 4.11 0.00 -0.43 -0.08 -1.26 -4.27 116.55 111.54 1wfy n ASP 56 Ca -0.07 -3.63 0.00 0.00 -1.51 0.00 0.00 54.79 49.58 1wfy n ASP 56 Cb 0.88 -0.85 0.00 0.00 2.34 0.00 0.00 41.12 43.49 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 -1.13 0.00 -3.37 -0.67 1.13 -1.24 -5.06 117.38 107.04 1wfy n GLN 57 Ca 0.60 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 55.28 1wfy n GLN 57 Cb 1.58 -0.34 -0.06 0.00 0.11 0.00 0.00 30.24 31.53 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 -1.94 4.86 -0.25 5.09 -7.23 -1.21 -3.85 120.40 115.88 1wfy s VAL 58 Ca 0.00 1.03 -0.03 0.00 -1.81 0.00 0.00 61.98 61.17 1wfy s VAL 58 Cb 0.00 -3.81 0.01 0.00 0.56 0.00 0.00 36.38 33.14 1wfy s VAL 58 CO 0.00 0.53 -0.03 -0.69 -0.31 0.00 0.00 175.10 174.60 1wfy s VAL 59 N -1.14 3.24 0.01 1.32 1.01 -1.14 -4.89 120.40 118.82 1wfy s VAL 59 Ca 0.28 -0.77 -0.18 0.00 0.00 0.00 0.00 61.98 61.31 1wfy s VAL 59 Cb -0.18 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.55 1wfy s VAL 59 CO 0.17 0.26 0.50 -0.22 0.00 0.00 0.00 175.10 175.81 1wfy s LEU 60 N 1.41 4.46 -0.30 3.92 0.20 -1.26 -1.62 118.68 125.50 1wfy s LEU 60 Ca 0.03 1.08 -0.16 0.00 0.69 0.00 0.00 54.13 55.77 1wfy s LEU 60 Cb -0.16 -2.76 0.18 0.00 -0.43 0.00 0.00 46.19 43.03 1wfy s LEU 60 CO -0.03 0.24 1.13 -1.38 -0.29 0.00 0.00 176.35 176.02 1wfy s HIS 61 N -0.77 -0.38 0.82 5.38 -3.43 -0.84 -0.29 115.29 115.77 1wfy s HIS 61 Ca 0.27 0.51 -0.11 0.00 -0.80 0.00 0.00 55.06 54.93 1wfy s HIS 61 Cb -0.18 0.17 0.09 0.00 -1.43 0.00 0.00 32.58 31.23 1wfy s HIS 61 CO 0.16 -0.20 1.12 -0.98 -2.00 0.00 0.00 174.74 172.84 1wfy s ARG 62 N 2.61 1.79 -1.17 -0.38 1.04 -1.26 -2.85 118.95 118.73 1wfy s ARG 62 Ca -0.02 1.39 -0.21 0.00 -1.04 0.00 0.00 55.73 55.84 1wfy s ARG 62 Cb -0.07 -1.83 -0.00 0.00 -2.04 0.00 0.00 34.95 31.01 1wfy s ARG 62 CO -0.13 -2.03 1.79 -1.25 -0.04 0.00 0.00 175.30 173.65 1wfy s PRO 63 N -4.66 3.21 0.00 3.89 0.04 -1.26 -2.39 135.00 133.82 1wfy s PRO 63 Ca 0.65 -1.35 0.00 0.00 0.04 0.00 0.00 61.00 60.34 1wfy s PRO 63 Cb -0.21 -5.35 0.00 0.00 0.04 0.00 0.00 34.50 28.99 1wfy s PRO 63 CO 0.55 -3.02 0.00 0.41 0.04 0.00 0.00 177.00 174.98 1wfy n GLY 64 N 5.95 0.30 0.08 0.56 0.00 -1.26 -4.97 105.19 105.86 1wfy n GLY 64 Ca 0.44 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.40 1wfy n GLY 64 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1wfy h GLU 65 N 0.00 0.00 0.00 1.61 4.39 -1.83 -3.47 114.58 115.27 1wfy h GLU 65 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1wfy h GLU 65 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1wfy h GLU 65 CO 0.00 0.46 0.00 1.17 -1.16 0.00 0.00 179.01 179.48 1wfy n LYS 66 N -3.02 0.00 -0.81 2.33 4.81 -1.22 -4.83 118.16 115.41 1wfy n LYS 66 Ca -0.14 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 56.97 1wfy n LYS 66 Cb 0.99 0.00 0.11 0.00 0.02 0.00 0.00 35.03 36.15 1wfy n LYS 66 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1wfy n GLN 67 N 0.00 -0.44 -2.40 1.64 3.00 -1.26 -4.85 117.38 113.07 1wfy n GLN 67 Ca 0.00 -0.10 -0.43 0.00 -0.01 0.00 0.00 57.00 56.46 1wfy n GLN 67 Cb 0.00 -1.68 -0.02 0.00 0.00 0.00 0.00 30.24 28.54 1wfy n GLN 67 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1wfy s PRO 68 N -3.31 4.11 1.18 -1.09 0.04 -1.26 -4.63 135.00 130.04 1wfy s PRO 68 Ca 0.53 1.54 -0.15 0.00 0.04 0.00 0.00 61.00 62.96 1wfy s PRO 68 Cb -0.18 -3.82 0.23 0.00 0.04 0.00 0.00 34.50 30.77 1wfy s PRO 68 CO 0.70 -0.87 0.63 -1.33 0.04 0.00 0.00 177.00 176.17 1wfy n MET 69 N 6.90 -2.30 -3.54 4.56 2.81 0.60 -4.96 117.12 121.19 1wfy n MET 69 Ca 0.14 -0.65 -0.41 0.00 -1.81 0.00 0.00 57.70 54.97 1wfy n MET 69 Cb 0.45 -1.98 -0.10 0.00 -0.71 0.00 0.00 33.22 30.88 1wfy n MET 69 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1wfy s ASP 70 N -2.18 5.82 0.35 7.83 -1.08 -1.26 -4.84 116.67 121.30 1wfy s ASP 70 Ca 0.64 -1.21 0.06 0.00 -0.52 0.00 0.00 52.55 51.52 1wfy s ASP 70 Cb -0.21 -2.06 0.72 0.00 -1.46 0.00 0.00 42.92 39.92 1wfy s ASP 70 CO 0.66 -0.49 1.91 -0.07 0.52 0.00 0.00 175.17 177.70 1wfy h LEU 71 N 8.51 0.71 -1.65 -1.34 3.38 -1.94 -0.26 115.31 122.72 1wfy h LEU 71 Ca -0.25 0.02 0.44 0.00 0.09 0.00 0.00 57.88 58.17 1wfy h LEU 71 Cb 1.10 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.66 1wfy h LEU 71 CO 0.74 0.42 1.26 1.05 0.09 0.00 0.00 178.44 182.01 1wfy h GLU 72 N 0.79 0.00 -7.02 1.13 -0.00 -1.95 0.11 114.58 107.64 1wfy h GLU 72 Ca 0.38 0.00 -0.50 0.00 -0.00 0.00 0.00 59.36 59.25 1wfy h GLU 72 Cb 0.43 0.00 0.05 0.00 -0.00 0.00 0.00 28.75 29.23 1wfy h GLU 72 CO -0.15 0.00 0.45 -0.80 -0.00 0.00 0.00 179.01 178.50 1wfy s ASN 73 N -3.90 6.21 0.27 3.06 0.01 -0.11 -4.67 114.94 115.81 1wfy s ASN 73 Ca -0.04 2.19 -0.30 0.00 -0.71 0.00 0.00 52.86 54.00 1wfy s ASN 73 Cb 0.21 -2.59 -0.09 0.00 0.41 0.00 0.00 41.25 39.19 1wfy s ASN 73 CO 0.72 -0.88 1.08 -2.16 -1.51 0.00 0.00 177.10 174.35 1wfy s PRO 74 N -2.84 4.66 0.61 -0.60 0.04 -1.26 -1.18 135.00 134.44 1wfy s PRO 74 Ca 0.65 1.77 0.30 0.00 0.04 0.00 0.00 61.00 63.75 1wfy s PRO 74 Cb -0.25 -3.21 1.61 0.00 0.04 0.00 0.00 34.50 32.70 1wfy s PRO 74 CO 0.30 0.24 1.99 -0.39 0.04 0.00 0.00 177.00 179.17 1wfy h VAL 75 N 3.15 0.30 -0.40 -0.36 -1.51 -1.37 0.21 116.25 116.27 1wfy h VAL 75 Ca -0.46 0.00 0.12 0.00 -1.23 0.00 0.00 66.70 65.12 1wfy h VAL 75 Cb 1.21 0.72 -0.02 0.00 -2.13 0.00 0.00 31.29 31.07 1wfy h VAL 75 CO 0.67 0.00 0.50 -1.28 -1.23 0.00 0.00 177.57 176.23 1wfy h SER 76 N 0.00 0.00 1.00 4.19 0.87 -1.78 1.28 113.55 119.12 1wfy h SER 76 Ca 0.11 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.52 1wfy h SER 76 Cb 0.78 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.72 1wfy h SER 76 CO -0.00 0.00 -1.06 -1.28 -0.53 0.00 0.00 176.83 173.96 1wfy h SER 77 N 0.00 0.00 -1.37 6.23 0.87 -0.91 -3.32 113.55 115.05 1wfy h SER 77 Ca 0.19 0.00 -0.66 0.00 -1.23 0.00 0.00 61.79 60.09 1wfy h SER 77 Cb 1.19 0.00 -0.34 0.00 -0.44 0.00 0.00 62.40 62.81 1wfy h SER 77 CO -0.00 0.59 0.25 1.33 -0.53 0.00 0.00 176.83 178.47 1wfy n VAL 78 N -3.05 3.13 -1.75 2.23 0.24 0.43 -4.69 118.33 114.87 1wfy n VAL 78 Ca -0.05 -4.05 -0.35 0.00 -2.04 0.00 0.00 64.34 57.85 1wfy n VAL 78 Cb 0.81 -1.20 0.05 0.00 -1.47 0.00 0.00 33.84 32.03 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 -0.67 6.14 -3.60 2.33 0.00 -0.72 -4.52 120.51 119.48 1wfy n ALA 79 Ca 0.51 -3.85 -0.04 0.00 0.00 0.00 0.00 53.44 50.07 1wfy n ALA 79 Cb 0.59 -1.58 -0.02 0.00 0.00 0.00 0.00 19.45 18.44 1wfy n ALA 79 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1wfy s SER 80 N -1.91 -0.13 0.48 0.00 0.01 -1.26 -4.83 113.70 106.06 1wfy s SER 80 Ca 0.57 -0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.80 1wfy s SER 80 Cb 0.46 0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.85 1wfy s SER 80 CO -0.18 -0.27 0.00 1.67 0.41 0.00 0.00 173.24 174.87 1wfy n GLN 81 N -0.17 -3.06 -3.81 12.44 7.27 -1.26 -4.79 117.38 124.00 1wfy n GLN 81 Ca -0.01 2.29 -0.36 0.00 0.07 0.00 0.00 57.00 58.99 1wfy n GLN 81 Cb 0.59 -3.65 -0.10 0.00 2.41 0.00 0.00 30.24 29.49 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 -3.24 4.99 0.82 1.69 2.01 -1.26 -3.81 115.64 116.85 1wfy s THR 82 Ca 0.00 0.05 -0.09 0.00 0.31 0.00 0.00 61.69 61.96 1wfy s THR 82 Cb 0.00 -3.30 0.14 0.00 0.01 0.00 0.00 72.50 69.35 1wfy s THR 82 CO 0.00 0.39 1.15 -0.76 -0.69 0.00 0.00 174.62 174.71 1wfy s LEU 83 N 0.85 2.82 -0.07 4.42 1.43 0.38 -4.36 118.68 124.15 1wfy s LEU 83 Ca 0.06 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 1wfy s LEU 83 Cb -0.13 -2.38 0.02 0.00 0.03 0.00 0.00 46.19 43.73 1wfy s LEU 83 CO 0.03 -2.19 -0.04 -0.69 0.23 0.00 0.00 176.35 173.68 1wfy s VAL 84 N -3.50 0.62 -0.04 -1.59 1.01 -1.13 0.82 120.40 116.59 1wfy s VAL 84 Ca 0.68 -0.10 -0.02 0.00 0.00 0.00 0.00 61.98 62.55 1wfy s VAL 84 Cb -0.06 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 1wfy s VAL 84 CO 0.48 0.28 0.06 -0.22 0.00 0.00 0.00 175.10 175.70 1wfy s LEU 85 N 1.41 3.86 -0.46 3.92 1.98 -0.22 -1.99 118.68 127.18 1wfy s LEU 85 Ca -0.03 0.18 0.03 0.00 -2.89 0.00 0.00 54.13 51.42 1wfy s LEU 85 Cb -0.13 -2.12 0.13 0.00 0.66 0.00 0.00 46.19 44.73 1wfy s LEU 85 CO -0.03 0.32 0.23 -0.62 -1.89 0.00 0.00 176.35 174.36 1wfy s ASP 86 N -1.41 4.05 0.78 3.68 -1.08 -0.64 -3.40 116.67 118.66 1wfy s ASP 86 Ca 0.19 -2.73 -0.13 0.00 -0.52 0.00 0.00 52.55 49.36 1wfy s ASP 86 Cb -0.12 -1.35 0.07 0.00 -1.46 0.00 0.00 42.92 40.06 1wfy s ASP 86 CO 0.09 -0.26 1.15 0.42 0.52 0.00 0.00 175.17 177.09 1wfy s THR 87 N 0.14 2.60 0.83 1.71 -4.23 -1.26 -2.87 115.64 112.56 1wfy s THR 87 Ca 0.17 0.24 -0.12 0.00 -1.18 0.00 0.00 61.69 60.80 1wfy s THR 87 Cb -0.25 -2.63 0.09 0.00 1.34 0.00 0.00 72.50 71.06 1wfy s THR 87 CO -0.01 -0.21 1.11 -2.16 -0.54 0.00 0.00 174.62 172.80 1wfy s PRO 88 N -4.37 1.80 0.70 3.99 0.04 -1.25 -4.96 135.00 130.95 1wfy s PRO 88 Ca 0.68 0.53 -0.11 0.00 0.04 0.00 0.00 61.00 62.14 1wfy s PRO 88 Cb -0.23 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.42 1wfy s PRO 88 CO 0.51 -1.80 1.06 -1.25 0.04 0.00 0.00 177.00 175.56 1wfy s PRO 89 N -5.20 2.87 -0.21 0.56 0.04 -1.26 -4.55 135.00 127.26 1wfy s PRO 89 Ca 0.62 0.93 -0.00 0.00 0.04 0.00 0.00 61.00 62.58 1wfy s PRO 89 Cb -0.14 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1wfy s PRO 89 CO 0.54 -1.14 0.01 -3.47 0.04 0.00 0.00 177.00 172.98 1wfy n ASP 90 N -3.15 -7.38 -3.17 6.66 -0.08 -1.26 -5.03 116.55 103.14 1wfy n ASP 90 Ca 0.07 1.13 0.02 0.00 -1.51 0.00 0.00 54.79 54.51 1wfy n ASP 90 Cb 0.54 -4.20 -0.01 0.00 2.34 0.00 0.00 41.12 39.79 1wfy n ASP 90 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1wfy s ALA 91 N -1.40 -2.54 -0.05 -1.67 0.00 -1.26 -5.05 121.76 109.79 1wfy s ALA 91 Ca -0.01 0.55 -0.05 0.00 0.00 0.00 0.00 51.96 52.45 1wfy s ALA 91 Cb 0.00 -2.70 -0.02 0.00 0.00 0.00 0.00 23.12 20.40 1wfy s ALA 91 CO 0.55 -2.12 -0.10 1.63 0.00 0.00 0.00 175.76 175.72 1wfy n LYS 92 N 4.69 0.16 -3.36 0.00 4.01 -1.26 -5.04 118.16 117.35 1wfy n LYS 92 Ca 0.09 0.06 -0.24 0.00 -0.51 0.00 0.00 58.31 57.71 1wfy n LYS 92 Cb 0.56 -0.75 0.02 0.00 -0.51 0.00 0.00 35.03 34.36 1wfy n LYS 92 CO 0.00 0.00 0.00 -0.12 -1.11 0.00 0.00 177.40 176.17 1wfy n MET 93 N -3.11 -1.38 -3.26 1.97 1.56 -1.26 -3.63 117.12 108.02 1wfy n MET 93 Ca -0.04 1.23 -0.28 0.00 -0.27 0.00 0.00 57.70 58.35 1wfy n MET 93 Cb 0.15 -1.81 0.03 0.00 2.15 0.00 0.00 33.22 33.74 1wfy n MET 93 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 1wfy n SER 94 N 0.36 -6.42 -3.65 6.12 3.41 -1.26 -4.99 113.62 107.19 1wfy n SER 94 Ca -0.05 0.10 0.04 0.00 -0.26 0.00 0.00 58.87 58.70 1wfy n SER 94 Cb 0.60 -3.05 0.00 0.00 -0.26 0.00 0.00 64.21 61.51 1wfy n SER 94 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1wfy s GLU 95 N -2.51 0.01 -0.02 4.33 2.02 -1.24 -5.18 118.70 116.12 1wfy s GLU 95 Ca 0.34 -0.01 -0.15 0.00 0.02 0.00 0.00 54.97 55.16 1wfy s GLU 95 Cb -0.05 0.00 0.03 0.00 0.10 0.00 0.00 34.13 34.21 1wfy s GLU 95 CO 0.84 -0.01 0.33 0.00 0.02 0.00 0.00 175.26 176.44 1wfy s ALA 96 N -2.01 -0.84 -0.28 5.21 0.00 -1.26 -4.97 121.76 117.61 1wfy s ALA 96 Ca 0.19 0.42 -0.26 0.00 0.00 0.00 0.00 51.96 52.31 1wfy s ALA 96 Cb 0.06 0.03 0.16 0.00 0.00 0.00 0.00 23.12 23.37 1wfy s ALA 96 CO -0.06 -0.26 1.24 0.50 0.00 0.00 0.00 175.76 177.18 1wfy s ARG 97 N -1.21 0.28 0.00 0.00 6.06 -1.26 -5.13 118.95 117.69 1wfy s ARG 97 Ca -0.12 0.29 0.00 0.00 -2.50 0.00 0.00 55.73 53.39 1wfy s ARG 97 Cb -0.05 0.13 0.00 0.00 0.06 0.00 0.00 34.95 35.10 1wfy s ARG 97 CO 0.04 -0.04 0.00 -1.13 -2.50 0.00 0.00 175.30 171.67 1wfy n SER 98 N 1.72 0.00 -3.15 -2.12 3.41 -1.26 -5.14 113.62 107.08 1wfy n SER 98 Ca -0.11 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.56 1wfy n SER 98 Cb 0.57 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.51 1wfy n SER 98 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wfy s SER 99 N 0.00 -0.34 -0.25 4.04 0.15 -1.26 -5.18 113.70 110.87 1wfy s SER 99 Ca 0.00 0.12 -0.33 0.00 0.70 0.00 0.00 55.95 56.44 1wfy s SER 99 Cb 0.00 1.24 0.16 0.00 -1.71 0.00 0.00 66.02 65.72 1wfy s SER 99 CO 0.00 -0.06 1.28 -0.83 1.20 0.00 0.00 173.24 174.83 1wfy s GLY 100 N 2.97 -0.11 0.56 9.45 0.00 -1.26 -5.14 107.32 113.78 1wfy s GLY 100 Ca 0.13 2.23 -0.17 0.00 0.00 0.00 0.00 44.72 46.91 1wfy s GLY 100 CO -0.16 0.85 1.05 2.56 0.00 0.00 0.00 173.10 177.39 1wfy s PRO 101 N -1.61 3.51 0.59 2.90 0.04 -1.26 -4.99 135.00 134.18 1wfy s PRO 101 Ca 0.08 1.23 -0.19 0.00 0.04 0.00 0.00 61.00 62.16 1wfy s PRO 101 Cb -0.01 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1wfy s PRO 101 CO -0.05 -0.66 1.08 0.43 0.04 0.00 0.00 177.00 177.85 1wfy n SER 102 N -1.69 1.31 -4.69 6.66 7.64 -1.26 -5.02 113.62 116.57 1wfy n SER 102 Ca 0.09 0.84 -0.25 0.00 1.01 0.00 0.00 58.87 60.56 1wfy n SER 102 Cb 0.53 -1.45 -0.08 0.00 -1.01 0.00 0.00 64.21 62.20 1wfy n SER 102 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wfy s SER 103 N -1.20 4.29 0.00 6.43 0.15 -1.26 -5.33 113.70 116.78 1wfy s SER 103 Ca 0.76 -1.06 0.00 0.00 0.70 0.00 0.00 55.95 56.35 1wfy s SER 103 Cb -0.42 -0.51 0.00 0.00 -1.71 0.00 0.00 66.02 63.38 1wfy s SER 103 CO 0.46 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 175.11