#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wfl s SER 2 N 0.00 -1.24 0.05 1.61 0.01 -1.26 -5.17 113.70 107.70 1wfl s SER 2 Ca 0.00 1.22 -0.27 0.00 1.31 0.00 0.00 55.95 58.21 1wfl s SER 2 Cb 0.00 2.22 0.09 0.00 0.21 0.00 0.00 66.02 68.54 1wfl s SER 2 CO 0.00 -0.23 0.86 -0.44 0.41 0.00 0.00 173.24 173.83 1wfl s SER 3 N 2.87 -0.36 0.00 2.44 0.01 -1.26 -5.10 113.70 112.30 1wfl s SER 3 Ca 0.07 -0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.26 1wfl s SER 3 Cb -0.13 0.43 0.00 0.00 0.21 0.00 0.00 66.02 66.53 1wfl s SER 3 CO -0.20 -0.72 0.00 0.61 0.41 0.00 0.00 173.24 173.34 1wfl n GLY 4 N -0.30 -0.53 2.84 3.44 0.00 -1.26 -5.15 105.19 104.24 1wfl n GLY 4 Ca -0.09 0.23 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 1wfl n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wfl s SER 5 N 0.00 0.82 -0.30 1.61 1.04 -1.26 -5.11 113.70 110.50 1wfl s SER 5 Ca 0.00 0.28 -0.15 0.00 0.48 0.00 0.00 55.95 56.56 1wfl s SER 5 Cb 0.00 0.33 0.18 0.00 0.10 0.00 0.00 66.02 66.63 1wfl s SER 5 CO 0.00 -0.26 1.09 -0.94 0.98 0.00 0.00 173.24 174.12 1wfl s SER 6 N 2.31 -0.38 0.18 7.02 1.04 -1.26 -5.16 113.70 117.46 1wfl s SER 6 Ca 0.03 0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.76 1wfl s SER 6 Cb -0.13 1.34 0.00 0.00 0.10 0.00 0.00 66.02 67.34 1wfl s SER 6 CO -0.07 -0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.69 1wfl n GLY 7 N 5.29 -1.81 3.74 7.32 0.00 -1.26 -4.90 105.19 113.58 1wfl n GLY 7 Ca -0.08 -1.34 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 1wfl n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wfl s PRO 8 N -1.92 4.41 -0.54 1.61 0.04 -1.26 -5.12 135.00 132.22 1wfl s PRO 8 Ca 0.00 2.05 -0.20 0.00 0.04 0.00 0.00 61.00 62.89 1wfl s PRO 8 Cb 0.00 -3.18 0.07 0.00 0.04 0.00 0.00 34.50 31.43 1wfl s PRO 8 CO 0.00 -0.19 0.70 -1.12 0.04 0.00 0.00 177.00 176.43 1wfl s SER 9 N 0.09 6.22 -0.46 6.66 0.01 -1.26 -4.99 113.70 119.97 1wfl s SER 9 Ca 0.54 -0.99 0.03 0.00 1.31 0.00 0.00 55.95 56.85 1wfl s SER 9 Cb -0.36 -2.32 0.13 0.00 0.21 0.00 0.00 66.02 63.68 1wfl s SER 9 CO 0.41 -1.02 0.22 -0.94 0.41 0.00 0.00 173.24 172.32 1wfl s SER 10 N 3.00 4.19 -0.58 2.44 1.04 -1.26 -5.02 113.70 117.51 1wfl s SER 10 Ca 0.16 -2.73 0.04 0.00 0.48 0.00 0.00 55.95 53.90 1wfl s SER 10 Cb -0.20 -1.44 0.16 0.00 0.10 0.00 0.00 66.02 64.65 1wfl s SER 10 CO 0.11 -0.27 0.40 -0.94 0.98 0.00 0.00 173.24 173.53 1wfl s SER 11 N 0.13 3.72 -0.29 7.02 1.04 -1.26 -5.04 113.70 119.01 1wfl s SER 11 Ca 0.16 -3.42 -0.16 0.00 0.48 0.00 0.00 55.95 53.01 1wfl s SER 11 Cb -0.24 -1.23 0.16 0.00 0.10 0.00 0.00 66.02 64.81 1wfl s SER 11 CO -0.02 -0.14 1.05 0.00 0.98 0.00 0.00 173.24 175.10 1wfl s GLN 12 N -0.73 0.28 -0.29 4.02 -2.07 -1.26 -5.17 119.66 114.45 1wfl s GLN 12 Ca 0.25 0.54 -0.16 0.00 -1.82 0.00 0.00 55.36 54.18 1wfl s GLN 12 Cb -0.06 0.14 0.14 0.00 -1.09 0.00 0.00 33.01 32.14 1wfl s GLN 12 CO -0.14 -0.07 0.95 -1.54 -1.32 0.00 0.00 175.29 173.17 1wfl s SER 13 N 1.57 -0.57 -0.73 12.60 1.04 -1.26 -5.11 113.70 121.25 1wfl s SER 13 Ca -0.07 0.88 0.01 0.00 0.48 0.00 0.00 55.95 57.25 1wfl s SER 13 Cb -0.04 1.33 0.18 0.00 0.10 0.00 0.00 66.02 67.59 1wfl s SER 13 CO -0.15 -0.13 0.54 -1.83 0.98 0.00 0.00 173.24 172.65 1wfl s GLU 14 N 1.60 2.68 -0.27 4.02 1.03 -1.26 -4.99 118.70 121.50 1wfl s GLU 14 Ca -0.08 -3.09 -0.00 0.00 0.03 0.00 0.00 54.97 51.83 1wfl s GLU 14 Cb -0.04 -3.63 0.15 0.00 -0.80 0.00 0.00 34.13 29.80 1wfl s GLU 14 CO -0.16 -1.23 0.42 -1.21 -1.33 0.00 0.00 175.26 171.75 1wfl s GLU 15 N -1.03 0.41 0.28 -4.83 2.02 -1.26 -5.14 118.70 109.16 1wfl s GLU 15 Ca 0.23 0.42 -0.26 0.00 0.02 0.00 0.00 54.97 55.39 1wfl s GLU 15 Cb -0.11 -0.27 -0.16 0.00 0.10 0.00 0.00 34.13 33.69 1wfl s GLU 15 CO -0.11 -0.82 0.42 0.36 0.02 0.00 0.00 175.26 175.14 1wfl n LYS 16 N 5.37 0.12 -3.64 1.61 0.00 -1.26 -4.98 118.16 115.37 1wfl n LYS 16 Ca -0.01 0.04 -0.05 0.00 -0.00 0.00 0.00 58.31 58.29 1wfl n LYS 16 Cb 0.50 -1.08 -0.07 0.00 -0.00 0.00 0.00 35.03 34.38 1wfl n LYS 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1wfl s ALA 17 N -1.24 -2.16 0.47 0.58 0.00 -1.26 -5.16 121.76 112.98 1wfl s ALA 17 Ca 0.62 2.09 -0.23 0.00 0.00 0.00 0.00 51.96 54.45 1wfl s ALA 17 Cb -0.80 -1.61 -0.07 0.00 0.00 0.00 0.00 23.12 20.63 1wfl s ALA 17 CO 0.58 -0.30 1.16 -1.25 0.00 0.00 0.00 175.76 175.95 1wfl s PRO 18 N 0.95 3.71 0.06 0.00 0.04 -1.26 -5.05 135.00 133.45 1wfl s PRO 18 Ca -0.05 1.75 0.06 0.00 0.04 0.00 0.00 61.00 62.81 1wfl s PRO 18 Cb -0.04 -2.36 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 1wfl s PRO 18 CO -0.12 -0.58 -0.13 -1.83 0.04 0.00 0.00 177.00 174.37 1wfl s GLU 19 N -2.76 2.17 0.06 4.56 4.04 -1.26 -5.13 118.70 120.38 1wfl s GLU 19 Ca 0.65 -0.96 0.01 0.00 0.04 0.00 0.00 54.97 54.71 1wfl s GLU 19 Cb -0.28 -2.28 -0.04 0.00 0.02 0.00 0.00 34.13 31.55 1wfl s GLU 19 CO 0.34 0.54 0.18 -0.51 -1.84 0.00 0.00 175.26 173.96 1wfl s LEU 20 N -1.72 4.22 0.58 1.83 1.43 -1.26 -5.09 118.68 118.66 1wfl s LEU 20 Ca 0.17 0.20 -0.18 0.00 -1.03 0.00 0.00 54.13 53.29 1wfl s LEU 20 Cb -0.11 -2.84 -0.04 0.00 0.03 0.00 0.00 46.19 43.23 1wfl s LEU 20 CO 0.09 0.17 1.12 -2.16 0.23 0.00 0.00 176.35 175.80 1wfl s PRO 21 N -2.47 3.20 0.51 1.29 0.04 -1.26 -4.94 135.00 131.36 1wfl s PRO 21 Ca 0.33 1.55 -0.14 0.00 0.04 0.00 0.00 61.00 62.79 1wfl s PRO 21 Cb -0.13 -1.99 -0.12 0.00 0.04 0.00 0.00 34.50 32.31 1wfl s PRO 21 CO 0.26 -0.96 -0.26 0.36 0.04 0.00 0.00 177.00 176.44 1wfl n LYS 22 N -1.61 0.00 0.00 4.56 2.85 -1.26 -4.70 118.16 118.00 1wfl n LYS 22 Ca 0.11 0.00 0.02 0.00 -1.05 0.00 0.00 58.31 57.40 1wfl n LYS 22 Cb 0.51 -0.77 0.14 0.00 -0.65 0.00 0.00 35.03 34.26 1wfl n LYS 22 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 1wfl n PRO 23 N 1.40 0.49 -3.95 -1.58 -0.04 -1.26 -4.55 135.00 125.51 1wfl n PRO 23 Ca 0.04 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.15 1wfl n PRO 23 Cb 0.38 -1.15 -0.14 0.00 -0.04 0.00 0.00 33.50 32.55 1wfl n PRO 23 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1wfl s LYS 24 N -2.00 2.91 -0.09 0.54 -0.14 -1.26 -5.00 119.74 114.70 1wfl s LYS 24 Ca 0.07 -0.93 -0.05 0.00 -1.36 0.00 0.00 55.97 53.70 1wfl s LYS 24 Cb 0.03 -2.99 -0.21 0.00 -1.68 0.00 0.00 37.83 32.98 1wfl s LYS 24 CO 0.05 -0.37 3.06 1.17 -0.76 0.00 0.00 175.35 178.50 1wfl n LYS 25 N 4.69 1.75 -4.14 1.68 4.81 -1.26 -4.67 118.16 121.01 1wfl n LYS 25 Ca -0.17 -0.90 -0.28 0.00 -0.87 0.00 0.00 58.31 56.09 1wfl n LYS 25 Cb 0.48 -1.96 -0.09 0.00 0.02 0.00 0.00 35.03 33.48 1wfl n LYS 25 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 1wfl n ASN 26 N 2.67 0.73 -4.11 3.14 6.94 -1.26 -4.87 115.26 118.50 1wfl n ASN 26 Ca 0.37 -1.15 -0.17 0.00 -0.02 0.00 0.00 54.58 53.62 1wfl n ASN 26 Cb 0.72 -1.43 -0.12 0.00 -2.36 0.00 0.00 39.78 36.59 1wfl n ASN 26 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1wfl s ARG 27 N -6.96 0.70 0.53 -3.83 0.52 -1.26 -1.63 118.95 107.02 1wfl s ARG 27 Ca 0.01 -0.77 -0.19 0.00 -0.52 0.00 0.00 55.73 54.26 1wfl s ARG 27 Cb -0.01 -0.62 -0.09 0.00 0.52 0.00 0.00 34.95 34.75 1wfl s ARG 27 CO 0.90 0.14 0.59 0.00 0.02 0.00 0.00 175.30 176.95 1wfl n PHE 29 N -1.44 0.45 -0.00 0.00 -0.00 0.16 -2.35 117.46 114.27 1wfl n PHE 29 Ca 0.11 -0.22 -0.01 0.00 -0.00 0.00 0.00 57.45 57.34 1wfl n PHE 29 Cb 0.45 0.00 -0.00 0.00 -0.00 0.00 0.00 39.48 39.93 1wfl n PHE 29 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.76 176.64 1wfl n MET 30 N 1.21 0.01 -0.00 -4.13 1.56 -1.26 -4.82 117.12 109.69 1wfl n MET 30 Ca 0.19 0.00 0.07 0.00 -0.27 0.00 0.00 57.70 57.69 1wfl n MET 30 Cb 0.54 -0.68 -0.10 0.00 2.15 0.00 0.00 33.22 35.13 1wfl n MET 30 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1wfl n ARG 32 N -1.81 -3.40 -4.62 0.00 3.00 -0.99 -4.95 116.66 103.89 1wfl n ARG 32 Ca -0.01 0.63 -0.32 0.00 -0.01 0.00 0.00 57.85 58.14 1wfl n ARG 32 Cb 0.33 -4.84 -0.12 0.00 0.00 0.00 0.00 32.46 27.84 1wfl n ARG 32 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 1wfl s LYS 33 N -4.55 2.44 -0.33 5.56 2.20 -1.26 -4.69 119.74 119.11 1wfl s LYS 33 Ca 0.15 -0.77 -0.28 0.00 -0.36 0.00 0.00 55.97 54.72 1wfl s LYS 33 Cb -0.02 -2.40 -0.06 0.00 -1.51 0.00 0.00 37.83 33.84 1wfl s LYS 33 CO 0.54 0.60 2.30 1.17 -0.36 0.00 0.00 175.35 179.59 1wfl n LYS 34 N 1.78 1.58 -0.13 4.03 0.00 -1.26 -0.91 118.16 123.25 1wfl n LYS 34 Ca -0.16 0.33 -0.17 0.00 0.00 0.00 0.00 58.31 58.30 1wfl n LYS 34 Cb 0.52 -3.27 -0.12 0.00 0.00 0.00 0.00 35.03 32.16 1wfl n LYS 34 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1wfl n VAL 35 N 7.83 1.47 0.00 3.15 0.24 -0.65 -4.96 118.33 125.41 1wfl n VAL 35 Ca 0.33 -0.59 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 1wfl n VAL 35 Cb 0.47 -1.33 0.00 0.00 -1.47 0.00 0.00 33.84 31.51 1wfl n VAL 35 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wfl n GLY 36 N 2.22 0.43 0.08 7.63 0.00 -1.01 0.43 105.19 114.98 1wfl n GLY 36 Ca -0.45 0.73 -0.08 0.00 0.00 0.00 0.00 46.02 46.23 1wfl n GLY 36 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wfl h LEU 37 N 0.00 0.00 -2.55 0.99 -0.00 -1.94 -3.33 115.31 108.49 1wfl h LEU 37 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.79 1wfl h LEU 37 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.61 1wfl h LEU 37 CO 0.00 0.99 0.12 0.35 -0.00 0.00 0.00 178.44 179.89 1wfl n THR 38 N -3.13 1.60 -2.25 0.22 -2.24 0.17 -4.91 114.28 103.75 1wfl n THR 38 Ca -0.12 -0.46 -0.31 0.00 -2.27 0.00 0.00 64.05 60.89 1wfl n THR 38 Cb 1.01 -1.06 -0.01 0.00 -2.10 0.00 0.00 70.33 68.17 1wfl n THR 38 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1wfl s GLY 39 N 0.83 1.86 -0.09 3.38 0.00 -1.24 -4.32 107.32 107.73 1wfl s GLY 39 Ca 0.10 -0.00 -0.00 0.00 0.00 0.00 0.00 44.72 44.81 1wfl s GLY 39 CO 0.01 0.26 -0.06 -0.12 0.00 0.00 0.00 173.10 173.19 1wfl s PHE 40 N -2.83 1.21 -0.34 1.90 2.19 0.43 -4.87 117.98 115.69 1wfl s PHE 40 Ca 0.56 -0.53 -0.17 0.00 0.33 0.00 0.00 56.93 57.11 1wfl s PHE 40 Cb -0.10 -1.06 -0.01 0.00 -1.31 0.00 0.00 43.02 40.53 1wfl s PHE 40 CO 0.41 -0.42 0.48 0.34 1.83 0.00 0.00 175.22 177.86 1wfl s ASP 41 N 1.63 6.30 0.66 6.13 2.15 -1.26 0.85 116.67 133.12 1wfl s ASP 41 Ca 0.02 -0.01 -0.06 0.00 0.43 0.00 0.00 52.55 52.94 1wfl s ASP 41 Cb -0.13 -2.25 0.04 0.00 -0.30 0.00 0.00 42.92 40.28 1wfl s ASP 41 CO -0.06 -0.43 0.96 0.00 -0.17 0.00 0.00 175.17 175.48 1wfl h ARG 43 N -0.42 0.00 0.00 0.00 2.47 -1.93 -2.32 114.38 112.18 1wfl h ARG 43 Ca -0.45 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 1wfl h ARG 43 Cb 1.29 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.61 1wfl h ARG 43 CO 0.60 0.39 0.00 0.00 0.56 0.00 0.00 179.97 181.52 1wfl n GLY 45 N -0.08 0.52 3.35 0.00 0.00 -0.87 -5.00 105.19 103.11 1wfl n GLY 45 Ca 0.10 -0.47 -0.19 0.00 0.00 0.00 0.00 46.02 45.47 1wfl n GLY 45 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wfl s ASN 46 N -3.12 1.60 -0.04 1.61 0.01 -1.25 -4.97 114.94 108.78 1wfl s ASN 46 Ca 0.04 -1.50 0.04 0.00 -0.71 0.00 0.00 52.86 50.73 1wfl s ASN 46 Cb -0.02 0.30 -0.03 0.00 0.41 0.00 0.00 41.25 41.91 1wfl s ASN 46 CO 0.10 -0.82 -0.15 -0.22 -1.51 0.00 0.00 177.10 174.49 1wfl s LEU 47 N -3.39 2.67 0.05 0.60 2.96 -1.26 -1.27 118.68 119.04 1wfl s LEU 47 Ca 0.35 -0.23 0.01 0.00 -0.22 0.00 0.00 54.13 54.04 1wfl s LEU 47 Cb 0.06 -1.54 -0.03 0.00 0.50 0.00 0.00 46.19 45.18 1wfl s LEU 47 CO 0.16 0.34 -0.05 -0.36 -1.32 0.00 0.00 176.35 175.12 1wfl s PHE 48 N -0.73 0.54 -0.52 5.38 0.40 0.25 0.39 117.98 123.69 1wfl s PHE 48 Ca 0.11 -0.75 0.02 0.00 -0.60 0.00 0.00 56.93 55.72 1wfl s PHE 48 Cb -0.11 -0.36 0.17 0.00 0.51 0.00 0.00 43.02 43.24 1wfl s PHE 48 CO 0.01 -0.21 0.96 0.00 0.70 0.00 0.00 175.22 176.67 1wfl n GLY 50 N 0.14 2.24 0.22 0.00 0.00 -1.26 -4.69 105.19 101.83 1wfl n GLY 50 Ca 0.09 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.21 1wfl n GLY 50 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wfl h LEU 51 N 0.00 0.00 -0.73 0.99 3.38 -1.94 -3.16 115.31 113.85 1wfl h LEU 51 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wfl h LEU 51 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1wfl h LEU 51 CO 0.00 0.24 -0.01 1.41 0.09 0.00 0.00 178.44 180.17 1wfl n HIS 52 N -3.40 0.00 -0.31 1.13 8.25 -1.26 -4.74 115.22 114.88 1wfl n HIS 52 Ca 0.00 0.00 0.20 0.00 -0.26 0.00 0.00 57.72 57.67 1wfl n HIS 52 Cb 0.44 0.00 0.39 0.00 1.12 0.00 0.00 29.99 31.94 1wfl n HIS 52 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1wfl n ARG 53 N -0.27 -0.07 -0.57 -0.41 1.85 -1.20 -4.09 116.66 111.91 1wfl n ARG 53 Ca 0.00 1.35 -0.15 0.00 -1.00 0.00 0.00 57.85 58.05 1wfl n ARG 53 Cb 0.01 -2.25 0.12 0.00 -1.05 0.00 0.00 32.46 29.30 1wfl n ARG 53 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1wfl n TYR 54 N -5.26 -2.20 -0.10 2.89 4.02 -1.26 -4.86 117.16 110.39 1wfl n TYR 54 Ca 0.27 0.10 -0.14 0.00 -0.01 0.00 0.00 57.90 58.12 1wfl n TYR 54 Cb 0.91 -1.38 -0.05 0.00 -0.02 0.00 0.00 39.34 38.80 1wfl n TYR 54 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1wfl n SER 55 N -0.52 1.91 0.00 7.72 3.41 -1.26 -4.18 113.62 120.70 1wfl n SER 55 Ca 0.05 0.41 0.04 0.00 -0.26 0.00 0.00 58.87 59.12 1wfl n SER 55 Cb 0.30 -0.81 0.23 0.00 -0.26 0.00 0.00 64.21 63.67 1wfl n SER 55 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1wfl n ASP 56 N -4.45 0.00 0.00 4.04 2.03 -1.26 -0.31 116.55 116.60 1wfl n ASP 56 Ca -0.23 0.02 -0.20 0.00 0.52 0.00 0.00 54.79 54.89 1wfl n ASP 56 Cb 0.56 -0.19 -0.14 0.00 -0.72 0.00 0.00 41.12 40.63 1wfl n ASP 56 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1wfl h LYS 57 N 0.00 0.21 -0.17 -0.67 1.79 -1.83 -3.37 116.57 112.53 1wfl h LYS 57 Ca 0.00 -0.36 0.00 0.00 -2.18 0.00 0.00 60.65 58.11 1wfl h LYS 57 Cb 0.06 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 1wfl h LYS 57 CO 0.00 1.17 0.00 -2.39 -1.08 0.00 0.00 179.45 177.15 1wfl n HIS 58 N -4.09 0.55 -3.59 -1.35 1.44 -0.97 -4.98 115.22 102.24 1wfl n HIS 58 Ca -0.21 -0.87 -0.21 0.00 -2.01 0.00 0.00 57.72 54.42 1wfl n HIS 58 Cb 0.82 -0.23 0.05 0.00 0.12 0.00 0.00 29.99 30.75 1wfl n HIS 58 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 1wfl n ASN 59 N -0.74 -2.54 -4.68 4.39 3.02 0.58 -4.83 115.26 110.45 1wfl n ASN 59 Ca 0.18 -0.79 -0.50 0.00 -0.03 0.00 0.00 54.58 53.44 1wfl n ASN 59 Cb 0.75 -4.34 -0.05 0.00 -0.61 0.00 0.00 39.78 35.53 1wfl n ASN 59 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wfl h PRO 61 N 8.32 0.41 -6.13 0.00 0.13 -1.91 -3.46 132.00 129.36 1wfl h PRO 61 Ca -0.48 -0.22 -0.39 0.00 -0.87 0.00 0.00 66.00 64.05 1wfl h PRO 61 Cb 1.28 0.01 0.20 0.00 0.13 0.00 0.00 31.00 32.62 1wfl h PRO 61 CO 0.94 0.78 -1.54 0.98 -0.23 0.00 0.00 178.00 178.93 1wfl n TYR 62 N -4.00 -1.49 -1.09 1.56 9.36 -1.26 -4.95 117.16 115.28 1wfl n TYR 62 Ca -0.02 0.39 0.01 0.00 3.32 0.00 0.00 57.90 61.60 1wfl n TYR 62 Cb 0.52 -1.44 0.01 0.00 -0.63 0.00 0.00 39.34 37.81 1wfl n TYR 62 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1wfl n ASP 63 N 0.98 0.56 -0.45 2.98 -0.08 -1.26 -4.86 116.55 114.41 1wfl n ASP 63 Ca 0.00 -1.62 0.35 0.00 -1.51 0.00 0.00 54.79 52.02 1wfl n ASP 63 Cb 0.57 -0.09 0.56 0.00 2.34 0.00 0.00 41.12 44.50 1wfl n ASP 63 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1wfl n TYR 64 N -0.22 0.17 -0.03 -0.67 4.11 -1.26 -0.93 117.16 118.33 1wfl n TYR 64 Ca 0.01 0.17 -0.02 0.00 -0.00 0.00 0.00 57.90 58.07 1wfl n TYR 64 Cb 0.52 -0.54 -0.01 0.00 -0.00 0.00 0.00 39.34 39.31 1wfl n TYR 64 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.86 177.73 1wfl h LYS 65 N 0.00 -0.03 -0.03 -3.48 1.57 -2.01 -2.84 116.57 109.74 1wfl h LYS 65 Ca 0.66 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.44 1wfl h LYS 65 Cb 2.49 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 34.81 1wfl h LYS 65 CO -0.12 -0.02 -0.00 0.00 -0.57 0.00 0.00 179.45 178.74 1wfl h ALA 66 N -1.01 0.04 -1.31 3.86 0.00 -1.46 -3.44 119.26 115.95 1wfl h ALA 66 Ca 0.01 -0.17 -0.75 0.00 0.00 0.00 0.00 54.91 54.00 1wfl h ALA 66 Cb 0.07 -0.01 0.05 0.00 0.00 0.00 0.00 17.79 17.89 1wfl h ALA 66 CO -0.09 -0.28 0.32 -1.91 0.00 0.00 0.00 179.25 177.28 1wfl n GLU 67 N -4.89 0.54 -3.64 0.00 2.13 -1.07 -4.94 120.64 108.76 1wfl n GLU 67 Ca -0.07 0.19 -0.07 0.00 0.66 0.00 0.00 57.16 57.87 1wfl n GLU 67 Cb 0.19 -1.76 -0.07 0.00 0.27 0.00 0.00 31.44 30.07 1wfl n GLU 67 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wfl s ALA 68 N 0.63 -2.07 -0.29 4.31 0.00 -1.26 -4.86 121.76 118.22 1wfl s ALA 68 Ca 0.90 1.79 -0.26 0.00 0.00 0.00 0.00 51.96 54.38 1wfl s ALA 68 Cb -1.15 -1.54 0.01 0.00 0.00 0.00 0.00 23.12 20.44 1wfl s ALA 68 CO 0.55 -0.19 0.93 -1.12 0.00 0.00 0.00 175.76 175.94 1wfl s SER 69 N 0.06 6.84 0.00 0.00 0.01 -1.26 -4.92 113.70 114.43 1wfl s SER 69 Ca 0.05 0.95 0.00 0.00 1.31 0.00 0.00 55.95 58.26 1wfl s SER 69 Cb -0.05 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.71 1wfl s SER 69 CO -0.10 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 173.46 1wfl n GLY 70 N 3.89 3.52 0.00 3.44 0.00 -1.26 -4.97 105.19 109.82 1wfl n GLY 70 Ca 0.08 -0.26 0.08 0.00 0.00 0.00 0.00 46.02 45.92 1wfl n GLY 70 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wfl n PRO 71 N 0.00 0.47 -1.94 1.61 -0.04 -1.26 -4.66 135.00 129.18 1wfl n PRO 71 Ca 0.00 0.01 -0.30 0.00 -0.04 0.00 0.00 63.50 63.17 1wfl n PRO 71 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 1wfl n PRO 71 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1wfl s SER 72 N -2.05 4.96 0.07 3.54 0.01 -1.26 -4.93 113.70 114.05 1wfl s SER 72 Ca 0.23 -0.06 0.06 0.00 1.31 0.00 0.00 55.95 57.49 1wfl s SER 72 Cb 0.11 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.77 1wfl s SER 72 CO 0.18 -2.77 -0.17 -0.55 0.41 0.00 0.00 173.24 170.35 1wfl s SER 73 N 8.83 1.98 0.00 2.44 0.15 -1.26 -5.17 113.70 120.67 1wfl s SER 73 Ca 0.75 -0.59 0.18 0.00 0.70 0.00 0.00 55.95 56.99 1wfl s SER 73 Cb -0.11 -0.10 0.15 0.00 -1.71 0.00 0.00 66.02 64.25 1wfl s SER 73 CO 0.10 0.01 1.08 0.61 1.20 0.00 0.00 173.24 176.25