#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 -0.30 -0.07 1.61 0.01 -1.26 -5.17 113.70 108.53 1wfl s SER 2 Ca 0.00 0.04 0.03 0.00 1.31 0.00 0.00 55.95 57.33 1wfl s SER 2 Cb 0.00 0.31 0.01 0.00 0.21 0.00 0.00 66.02 66.55 1wfl s SER 2 CO 0.00 -0.48 -0.15 -0.94 0.41 0.00 0.00 173.24 172.08 1wfl s SER 3 N -2.25 2.07 0.00 2.44 1.04 -1.26 -4.96 113.70 110.78 1wfl s SER 3 Ca 0.06 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.13 1wfl s SER 3 Cb -0.01 -0.90 0.00 0.00 0.10 0.00 0.00 66.02 65.21 1wfl s SER 3 CO -0.07 0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.84 1wfl n GLY 4 N 3.65 0.00 3.23 7.32 0.00 -1.26 -5.10 105.19 113.03 1wfl n GLY 4 Ca -0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 6.34 -0.30 1.61 1.04 -1.26 -4.95 113.70 116.18 1wfl s SER 5 Ca 0.00 -3.08 -0.07 0.00 0.48 0.00 0.00 55.95 53.27 1wfl s SER 5 Cb 0.00 -2.07 0.18 0.00 0.10 0.00 0.00 66.02 64.24 1wfl s SER 5 CO 0.00 -0.40 0.83 -0.55 0.98 0.00 0.00 173.24 174.10 1wfl s SER 6 N 1.22 -0.91 0.00 7.02 0.15 -1.26 -5.16 113.70 114.75 1wfl s SER 6 Ca 0.22 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.45 1wfl s SER 6 Cb -0.12 1.77 0.00 0.00 -1.71 0.00 0.00 66.02 65.96 1wfl s SER 6 CO -0.08 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.80 1wfl n GLY 7 N 5.45 3.34 3.66 9.45 0.00 -1.26 -4.89 105.19 120.94 1wfl n GLY 7 Ca -0.04 -1.82 -0.29 0.00 0.00 0.00 0.00 46.02 43.87 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 -2.39 0.07 -0.26 1.61 0.04 -1.26 -5.13 135.00 127.68 1wfl s PRO 8 Ca 0.00 0.40 -0.08 0.00 0.04 0.00 0.00 61.00 61.36 1wfl s PRO 8 Cb 0.00 -1.71 -0.03 0.00 0.04 0.00 0.00 34.50 32.81 1wfl s PRO 8 CO 0.00 -2.95 0.08 -1.12 0.04 0.00 0.00 177.00 173.06 1wfl s SER 9 N -3.52 5.23 0.17 6.66 0.01 -1.26 -5.07 113.70 115.92 1wfl s SER 9 Ca 0.66 -0.22 -0.16 0.00 1.31 0.00 0.00 55.95 57.55 1wfl s SER 9 Cb -0.17 -1.94 0.02 0.00 0.21 0.00 0.00 66.02 64.14 1wfl s SER 9 CO 0.57 -0.05 0.45 -0.94 0.41 0.00 0.00 173.24 173.69 1wfl s SER 10 N 1.62 -0.21 -0.19 2.44 1.04 -1.26 -5.17 113.70 111.97 1wfl s SER 10 Ca 0.06 -0.50 -0.14 0.00 0.48 0.00 0.00 55.95 55.86 1wfl s SER 10 Cb -0.15 0.53 0.06 0.00 0.10 0.00 0.00 66.02 66.55 1wfl s SER 10 CO 0.04 -0.97 0.49 -0.55 0.98 0.00 0.00 173.24 173.22 1wfl s SER 11 N -2.87 -0.58 -0.02 7.02 0.15 -1.26 -5.17 113.70 110.97 1wfl s SER 11 Ca 0.09 1.03 -0.10 0.00 0.70 0.00 0.00 55.95 57.66 1wfl s SER 11 Cb 0.00 0.96 0.01 0.00 -1.71 0.00 0.00 66.02 65.29 1wfl s SER 11 CO -0.05 -0.19 0.22 -1.10 1.20 0.00 0.00 173.24 173.32 1wfl s GLN 12 N 0.96 0.51 -0.26 5.44 -0.21 -1.26 -5.16 119.66 119.67 1wfl s GLN 12 Ca -0.06 -0.17 -0.12 0.00 0.02 0.00 0.00 55.36 55.04 1wfl s GLN 12 Cb -0.06 0.22 0.09 0.00 1.00 0.00 0.00 33.01 34.27 1wfl s GLN 12 CO -0.08 -0.12 0.60 -1.54 -2.12 0.00 0.00 175.29 172.03 1wfl s SER 13 N -1.04 -0.87 -0.28 5.90 1.04 -1.26 -5.13 113.70 112.06 1wfl s SER 13 Ca -0.11 1.39 -0.01 0.00 0.48 0.00 0.00 55.95 57.70 1wfl s SER 13 Cb -0.06 1.60 0.09 0.00 0.10 0.00 0.00 66.02 67.76 1wfl s SER 13 CO 0.02 -0.23 0.07 -1.61 0.98 0.00 0.00 173.24 172.48 1wfl s GLU 14 N 2.15 0.84 -0.28 4.02 2.02 -1.26 -5.09 118.70 121.10 1wfl s GLU 14 Ca -0.08 -1.00 -0.16 0.00 0.02 0.00 0.00 54.97 53.75 1wfl s GLU 14 Cb -0.09 -2.14 0.08 0.00 0.10 0.00 0.00 34.13 32.08 1wfl s GLU 14 CO -0.18 -0.89 0.69 -1.83 0.02 0.00 0.00 175.26 173.07 1wfl s GLU 15 N 1.59 0.71 0.14 1.61 -1.05 -1.26 -5.17 118.70 115.28 1wfl s GLU 15 Ca 0.06 1.20 -0.24 0.00 -0.15 0.00 0.00 54.97 55.84 1wfl s GLU 15 Cb -0.17 0.16 0.08 0.00 -0.44 0.00 0.00 34.13 33.75 1wfl s GLU 15 CO -0.19 -0.15 1.04 -1.59 0.95 0.00 0.00 175.26 175.32 1wfl s LYS 16 N 1.55 1.14 0.17 -4.83 0.00 -1.26 -5.18 119.74 111.32 1wfl s LYS 16 Ca -0.09 -0.68 0.09 0.00 0.00 0.00 0.00 55.97 55.28 1wfl s LYS 16 Cb -0.05 0.35 -0.04 0.00 0.00 0.00 0.00 37.83 38.09 1wfl s LYS 16 CO -0.18 -0.53 -0.18 0.00 0.00 0.00 0.00 175.35 174.45 1wfl s ALA 17 N -2.65 2.06 -0.21 0.59 0.00 -1.26 -5.10 121.76 115.19 1wfl s ALA 17 Ca 0.17 -1.52 -0.29 0.00 0.00 0.00 0.00 51.96 50.32 1wfl s ALA 17 Cb -0.01 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.89 1wfl s ALA 17 CO 0.03 0.24 1.60 -1.25 0.00 0.00 0.00 175.76 176.38 1wfl s PRO 18 N -2.85 3.83 -0.29 0.00 0.04 -1.26 -4.97 135.00 129.50 1wfl s PRO 18 Ca 0.17 1.69 -0.12 0.00 0.04 0.00 0.00 61.00 62.78 1wfl s PRO 18 Cb -0.06 -4.02 0.12 0.00 0.04 0.00 0.00 34.50 30.58 1wfl s PRO 18 CO 0.07 -1.25 0.71 -2.00 0.04 0.00 0.00 177.00 174.57 1wfl s GLU 19 N 4.59 0.58 0.02 4.56 2.56 -1.26 -5.17 118.70 124.58 1wfl s GLU 19 Ca 0.71 1.30 -0.04 0.00 0.00 0.00 0.00 54.97 56.94 1wfl s GLU 19 Cb -0.25 0.61 -0.01 0.00 2.00 0.00 0.00 34.13 36.47 1wfl s GLU 19 CO 0.29 -0.17 0.06 -0.51 -0.56 0.00 0.00 175.26 174.36 1wfl s LEU 20 N 2.45 1.93 1.23 2.70 1.43 -1.26 -5.17 118.68 121.99 1wfl s LEU 20 Ca -0.07 -0.48 -0.20 0.00 -1.03 0.00 0.00 54.13 52.35 1wfl s LEU 20 Cb -0.09 0.44 0.30 0.00 0.03 0.00 0.00 46.19 46.86 1wfl s LEU 20 CO -0.19 -0.42 1.11 -2.16 0.23 0.00 0.00 176.35 174.92 1wfl s PRO 21 N -2.07 -1.44 0.68 1.29 0.04 -1.26 -4.95 135.00 127.29 1wfl s PRO 21 Ca -0.10 -0.14 -0.17 0.00 0.04 0.00 0.00 61.00 60.63 1wfl s PRO 21 Cb -0.05 -1.58 -0.13 0.00 0.04 0.00 0.00 34.50 32.79 1wfl s PRO 21 CO -0.02 -3.84 -0.19 1.63 0.04 0.00 0.00 177.00 174.62 1wfl n LYS 22 N -4.84 0.06 0.04 4.56 4.76 -1.26 -4.91 118.16 116.57 1wfl n LYS 22 Ca 0.14 0.03 -0.13 0.00 -2.87 0.00 0.00 58.31 55.48 1wfl n LYS 22 Cb 0.60 -1.15 -0.09 0.00 -1.84 0.00 0.00 35.03 32.54 1wfl n LYS 22 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1wfl h PRO 23 N -0.34 -0.14 -2.60 1.97 0.13 -2.02 -3.39 132.00 125.61 1wfl h PRO 23 Ca -0.43 0.01 -0.60 0.00 -0.87 0.00 0.00 66.00 64.11 1wfl h PRO 23 Cb 1.39 0.03 -0.40 0.00 0.13 0.00 0.00 31.00 32.15 1wfl h PRO 23 CO 0.37 0.30 -0.77 1.63 -0.23 0.00 0.00 178.00 179.30 1wfl n LYS 24 N -4.93 1.25 0.29 0.86 4.01 -1.26 -4.98 118.16 113.39 1wfl n LYS 24 Ca -0.09 -3.93 -0.17 0.00 -0.51 0.00 0.00 58.31 53.61 1wfl n LYS 24 Cb 0.25 -1.96 -0.09 0.00 -0.51 0.00 0.00 35.03 32.72 1wfl n LYS 24 CO 0.00 0.00 0.00 -0.22 -1.11 0.00 0.00 177.40 176.07 1wfl h LYS 25 N 5.15 -0.92 -0.74 1.97 1.63 -1.97 -3.34 116.57 118.34 1wfl h LYS 25 Ca 0.19 0.06 -0.38 0.00 -0.85 0.00 0.00 60.65 59.67 1wfl h LYS 25 Cb 0.81 0.21 -0.41 0.00 -0.60 0.00 0.00 32.23 32.24 1wfl h LYS 25 CO 0.59 -0.62 -1.02 0.27 -3.45 0.00 0.00 179.45 175.23 1wfl n ASN 26 N -5.31 2.74 -4.04 4.20 6.94 -1.26 -5.03 115.26 113.50 1wfl n ASN 26 Ca -0.11 -2.78 -0.18 0.00 -0.02 0.00 0.00 54.58 51.48 1wfl n ASN 26 Cb 0.44 -0.45 -0.14 0.00 -2.36 0.00 0.00 39.78 37.26 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 -3.59 0.73 0.60 -3.83 0.52 -1.26 -1.77 118.95 110.35 1wfl s ARG 27 Ca 0.35 -0.44 -0.18 0.00 -0.52 0.00 0.00 55.73 54.95 1wfl s ARG 27 Cb 0.38 -0.69 -0.09 0.00 0.52 0.00 0.00 34.95 35.07 1wfl s ARG 27 CO -0.02 0.18 0.38 0.00 0.02 0.00 0.00 175.30 175.86 1wfl n PHE 29 N -1.82 0.23 -0.03 0.00 -0.00 0.29 -2.68 117.46 113.45 1wfl n PHE 29 Ca 0.10 -0.12 -0.06 0.00 -0.00 0.00 0.00 57.45 57.37 1wfl n PHE 29 Cb 0.48 -0.00 -0.02 0.00 -0.00 0.00 0.00 39.48 39.94 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 1.38 0.14 -0.01 -4.13 1.56 -1.26 -4.80 117.12 110.01 1wfl n MET 30 Ca 0.16 0.05 0.07 0.00 -0.27 0.00 0.00 57.70 57.72 1wfl n MET 30 Cb 0.59 -0.84 -0.11 0.00 2.15 0.00 0.00 33.22 35.01 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 -1.88 -3.22 -5.01 0.00 3.00 -1.09 -4.97 116.66 103.49 1wfl n ARG 32 Ca -0.02 0.62 -0.32 0.00 -0.01 0.00 0.00 57.85 58.12 1wfl n ARG 32 Cb 0.35 -4.78 -0.14 0.00 0.00 0.00 0.00 32.46 27.89 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 -4.50 2.30 -0.36 5.56 2.20 -1.26 -4.72 119.74 118.96 1wfl s LYS 33 Ca 0.16 -0.82 -0.30 0.00 -0.36 0.00 0.00 55.97 54.65 1wfl s LYS 33 Cb -0.02 -2.23 -0.08 0.00 -1.51 0.00 0.00 37.83 33.99 1wfl s LYS 33 CO 0.53 0.59 2.28 1.17 -0.36 0.00 0.00 175.35 179.56 1wfl n LYS 34 N 2.25 1.37 -0.11 4.03 3.00 -1.26 -1.36 118.16 126.08 1wfl n LYS 34 Ca -0.17 0.31 -0.17 0.00 -0.00 0.00 0.00 58.31 58.29 1wfl n LYS 34 Cb 0.52 -2.94 -0.13 0.00 0.00 0.00 0.00 35.03 32.48 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 7.62 1.50 0.00 3.15 0.24 -0.73 -4.96 118.33 125.15 1wfl n VAL 35 Ca 0.37 -0.63 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 1wfl n VAL 35 Cb 0.37 -1.27 0.00 0.00 -1.47 0.00 0.00 33.84 31.47 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 2.14 1.50 0.09 7.63 0.00 -1.08 -0.17 105.19 115.31 1wfl n GLY 36 Ca -0.42 0.46 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.84 0.99 3.38 -1.95 -3.25 115.31 111.64 1wfl h LEU 37 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1wfl h LEU 37 Cb 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.67 1wfl h LEU 37 CO 0.00 0.82 0.21 0.35 0.09 0.00 0.00 178.44 179.91 1wfl n THR 38 N -3.33 1.95 -2.25 0.22 -2.24 0.76 -4.91 114.28 104.49 1wfl n THR 38 Ca 0.01 -0.79 -0.26 0.00 -2.27 0.00 0.00 64.05 60.73 1wfl n THR 38 Cb 0.86 -1.07 0.06 0.00 -2.10 0.00 0.00 70.33 68.08 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 0.58 1.67 -0.05 3.38 0.00 -1.23 -4.36 107.32 107.30 1wfl s GLY 39 Ca 0.17 -0.86 -0.02 0.00 0.00 0.00 0.00 44.72 44.01 1wfl s GLY 39 CO 0.02 -0.48 0.09 -0.12 0.00 0.00 0.00 173.10 172.61 1wfl s PHE 40 N -3.18 -0.05 -0.35 1.90 2.19 0.36 -4.80 117.98 114.04 1wfl s PHE 40 Ca 0.58 0.35 -0.14 0.00 0.33 0.00 0.00 56.93 58.05 1wfl s PHE 40 Cb -0.11 -0.29 -0.01 0.00 -1.31 0.00 0.00 43.02 41.31 1wfl s PHE 40 CO 0.45 -0.18 0.31 -0.51 1.83 0.00 0.00 175.22 177.12 1wfl s ASP 41 N 1.70 6.12 0.65 6.13 1.01 -1.26 0.76 116.67 131.78 1wfl s ASP 41 Ca -0.02 -0.41 -0.07 0.00 0.71 0.00 0.00 52.55 52.76 1wfl s ASP 41 Cb -0.12 -2.17 0.03 0.00 1.01 0.00 0.00 42.92 41.67 1wfl s ASP 41 CO -0.04 -0.33 0.96 0.00 0.21 0.00 0.00 175.17 175.97 1wfl h ARG 43 N -0.38 0.00 0.00 0.00 2.47 -1.95 -2.41 114.38 112.12 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 1.28 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.60 1wfl h ARG 43 CO 0.61 0.41 0.00 0.00 0.56 0.00 0.00 179.97 181.55 1wfl n GLY 45 N -0.08 0.52 3.24 0.00 0.00 -0.90 -5.00 105.19 102.97 1wfl n GLY 45 Ca 0.10 -0.48 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.09 0.74 -0.05 1.61 0.01 -1.25 -4.97 114.94 107.94 1wfl s ASN 46 Ca 0.02 -1.32 0.03 0.00 -0.71 0.00 0.00 52.86 50.87 1wfl s ASN 46 Cb -0.01 0.24 -0.03 0.00 0.41 0.00 0.00 41.25 41.87 1wfl s ASN 46 CO 0.06 -0.74 -0.11 -0.22 -1.51 0.00 0.00 177.10 174.59 1wfl s LEU 47 N -3.20 2.96 0.04 0.60 2.96 -1.26 -0.95 118.68 119.83 1wfl s LEU 47 Ca 0.34 -0.12 0.00 0.00 -0.22 0.00 0.00 54.13 54.13 1wfl s LEU 47 Cb 0.07 -1.64 -0.03 0.00 0.50 0.00 0.00 46.19 45.10 1wfl s LEU 47 CO 0.10 0.34 -0.04 -0.36 -1.32 0.00 0.00 176.35 175.07 1wfl s PHE 48 N -0.80 0.45 -0.59 5.38 0.40 0.23 0.11 117.98 123.16 1wfl s PHE 48 Ca 0.13 -0.69 0.01 0.00 -0.60 0.00 0.00 56.93 55.77 1wfl s PHE 48 Cb -0.11 -0.31 0.10 0.00 0.51 0.00 0.00 43.02 43.22 1wfl s PHE 48 CO 0.02 -0.22 0.83 0.00 0.70 0.00 0.00 175.22 176.55 1wfl n GLY 50 N 0.16 2.17 0.23 0.00 0.00 -1.26 -4.69 105.19 101.79 1wfl n GLY 50 Ca 0.05 -0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 0.99 4.07 -1.94 -3.21 115.31 115.22 1wfl h LEU 51 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1wfl h LEU 51 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1wfl h LEU 51 CO 0.00 0.19 -0.50 1.41 -1.08 0.00 0.00 178.44 178.46 1wfl n HIS 52 N -3.29 0.00 -0.25 1.13 8.25 -1.26 -4.72 115.22 115.08 1wfl n HIS 52 Ca 0.01 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.53 1wfl n HIS 52 Cb 0.44 -0.03 0.14 0.00 1.12 0.00 0.00 29.99 31.66 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 -1.26 -0.06 -1.38 -0.41 1.85 -1.21 -3.85 116.66 110.33 1wfl n ARG 53 Ca 0.00 1.07 -0.38 0.00 -1.00 0.00 0.00 57.85 57.54 1wfl n ARG 53 Cb 0.08 -1.64 0.03 0.00 -1.05 0.00 0.00 32.46 29.88 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 -5.06 -1.51 0.02 2.89 4.02 -1.26 -4.89 117.16 111.37 1wfl n TYR 54 Ca 0.13 0.45 -0.16 0.00 -0.01 0.00 0.00 57.90 58.31 1wfl n TYR 54 Cb 0.43 -1.85 -0.06 0.00 -0.02 0.00 0.00 39.34 37.84 1wfl n TYR 54 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1wfl h SER 55 N 0.14 0.78 -0.16 7.72 4.64 -1.96 -3.05 113.55 121.66 1wfl h SER 55 Ca -0.44 -0.56 -0.01 0.00 -0.47 0.00 0.00 61.79 60.32 1wfl h SER 55 Cb 1.42 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1wfl h SER 55 CO 0.45 1.35 0.01 -0.67 -0.87 0.00 0.00 176.83 177.10 1wfl n ASP 56 N -3.87 2.35 -0.03 4.97 2.03 -1.26 -0.88 116.55 119.86 1wfl n ASP 56 Ca -0.08 -2.27 -0.04 0.00 0.52 0.00 0.00 54.79 52.92 1wfl n ASP 56 Cb 0.79 -0.55 -0.04 0.00 -0.72 0.00 0.00 41.12 40.60 1wfl n ASP 56 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1wfl n LYS 57 N 0.17 0.78 -0.19 -0.67 4.76 -1.16 -4.71 118.16 117.14 1wfl n LYS 57 Ca 0.08 0.03 0.09 0.00 -2.87 0.00 0.00 58.31 55.64 1wfl n LYS 57 Cb 0.53 -1.14 0.16 0.00 -1.84 0.00 0.00 35.03 32.74 1wfl n LYS 57 CO 0.00 0.00 0.00 -2.39 -1.37 0.00 0.00 177.40 173.64 1wfl n HIS 58 N -2.60 0.15 -3.67 2.13 1.44 -1.21 -4.97 115.22 106.49 1wfl n HIS 58 Ca -0.12 -1.05 -0.21 0.00 -2.01 0.00 0.00 57.72 54.33 1wfl n HIS 58 Cb 0.64 -0.19 0.04 0.00 0.12 0.00 0.00 29.99 30.60 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 -1.28 -1.48 -4.68 4.39 3.02 -1.01 -4.83 115.26 109.40 1wfl n ASN 59 Ca 0.17 -0.81 -0.50 0.00 -0.03 0.00 0.00 54.58 53.42 1wfl n ASN 59 Cb 0.69 -4.14 -0.05 0.00 -0.61 0.00 0.00 39.78 35.67 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 8.47 0.22 -6.25 0.00 0.13 -1.90 -3.46 132.00 129.22 1wfl h PRO 61 Ca -0.48 -0.12 -0.49 0.00 -0.87 0.00 0.00 66.00 64.04 1wfl h PRO 61 Cb 1.28 0.00 0.25 0.00 0.13 0.00 0.00 31.00 32.66 1wfl h PRO 61 CO 0.94 0.65 -2.01 0.98 -0.23 0.00 0.00 178.00 178.33 1wfl n TYR 62 N -3.98 -1.85 -1.02 1.56 9.36 -1.26 -4.95 117.16 115.02 1wfl n TYR 62 Ca -0.02 0.40 0.01 0.00 3.32 0.00 0.00 57.90 61.61 1wfl n TYR 62 Cb 0.52 -1.47 0.01 0.00 -0.63 0.00 0.00 39.34 37.77 1wfl n TYR 62 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 1wfl n ASP 63 N 1.68 0.53 -0.68 2.98 9.92 -1.26 -4.85 116.55 124.86 1wfl n ASP 63 Ca -0.01 -1.52 0.52 0.00 -0.53 0.00 0.00 54.79 53.25 1wfl n ASP 63 Cb 0.68 -0.07 0.81 0.00 -0.64 0.00 0.00 41.12 41.90 1wfl n ASP 63 CO 0.00 0.00 0.00 0.10 0.13 0.00 0.00 177.20 177.43 1wfl h TYR 64 N 0.00 0.06 -0.56 1.24 -0.00 -1.95 1.18 116.97 116.93 1wfl h TYR 64 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1wfl h TYR 64 Cb 0.99 -0.01 -0.03 0.00 -0.00 0.00 0.00 36.73 37.68 1wfl h TYR 64 CO 0.02 -0.03 0.34 1.57 -0.00 0.00 0.00 178.16 180.06 1wfl h LYS 65 N 0.00 0.76 -1.00 0.10 2.10 -1.88 -2.60 116.57 114.05 1wfl h LYS 65 Ca 0.93 -0.07 -0.68 0.00 -2.00 0.00 0.00 60.65 58.84 1wfl h LYS 65 Cb 3.67 -0.16 -0.29 0.00 -0.90 0.00 0.00 32.23 34.55 1wfl h LYS 65 CO -0.06 0.55 0.86 0.00 -2.00 0.00 0.00 179.45 178.80 1wfl n ALA 66 N -2.28 6.33 0.05 0.07 0.00 0.40 -3.96 120.51 121.13 1wfl n ALA 66 Ca 0.03 -3.48 0.00 0.00 0.00 0.00 0.00 53.44 49.99 1wfl n ALA 66 Cb 0.05 -1.76 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1wfl n ALA 66 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1wfl n GLU 67 N -0.92 0.00 -3.55 0.00 4.07 -0.99 -5.06 120.64 114.18 1wfl n GLU 67 Ca 0.63 0.00 -0.16 0.00 -0.06 0.00 0.00 57.16 57.57 1wfl n GLU 67 Cb 0.67 -0.29 -0.06 0.00 -0.06 0.00 0.00 31.44 31.70 1wfl n GLU 67 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1wfl s ALA 68 N -2.00 -1.81 -1.48 4.31 0.00 -1.15 -4.96 121.76 114.67 1wfl s ALA 68 Ca 0.00 1.51 -0.03 0.00 0.00 0.00 0.00 51.96 53.45 1wfl s ALA 68 Cb 0.00 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.75 1wfl s ALA 68 CO 0.00 -0.35 0.38 0.43 0.00 0.00 0.00 175.76 176.22 1wfl n SER 69 N 1.24 -0.41 -3.20 0.00 7.64 -1.26 -4.76 113.62 112.87 1wfl n SER 69 Ca -0.16 -1.07 -0.24 0.00 1.01 0.00 0.00 58.87 58.41 1wfl n SER 69 Cb 0.57 -2.70 -0.06 0.00 -1.01 0.00 0.00 64.21 61.01 1wfl n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wfl n GLY 70 N -2.03 4.30 3.57 0.23 0.00 -1.25 -4.98 105.19 105.03 1wfl n GLY 70 Ca -0.26 -2.27 -0.30 0.00 0.00 0.00 0.00 46.02 43.18 1wfl n GLY 70 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wfl s PRO 71 N -2.40 -1.64 -0.66 1.61 0.04 -1.26 -4.80 135.00 125.89 1wfl s PRO 71 Ca 0.41 -0.22 -0.11 0.00 0.04 0.00 0.00 61.00 61.12 1wfl s PRO 71 Cb 0.23 -1.56 0.17 0.00 0.04 0.00 0.00 34.50 33.38 1wfl s PRO 71 CO -0.08 -3.96 0.57 -1.12 0.04 0.00 0.00 177.00 172.45 1wfl s SER 72 N -4.01 6.15 0.34 6.66 0.01 -1.26 -5.06 113.70 116.53 1wfl s SER 72 Ca 0.72 -2.39 -0.26 0.00 1.31 0.00 0.00 55.95 55.34 1wfl s SER 72 Cb -0.07 -2.10 -0.10 0.00 0.21 0.00 0.00 66.02 63.96 1wfl s SER 72 CO 0.56 -0.62 0.99 -0.55 0.41 0.00 0.00 173.24 174.03 1wfl s SER 73 N 2.27 7.15 0.00 2.44 0.15 -1.26 -5.36 113.70 119.10 1wfl s SER 73 Ca 0.12 1.93 0.31 0.00 0.70 0.00 0.00 55.95 59.01 1wfl s SER 73 Cb -0.19 -2.58 1.62 0.00 -1.71 0.00 0.00 66.02 63.16 1wfl s SER 73 CO -0.04 -0.20 2.07 0.61 1.20 0.00 0.00 173.24 176.87