#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wfz s SER 2 N 0.00 5.47 -0.18 1.61 1.04 -1.26 -5.12 113.70 115.26 1wfz s SER 2 Ca 0.00 -0.11 -0.15 0.00 0.48 0.00 0.00 55.95 56.17 1wfz s SER 2 Cb 0.00 -1.43 0.05 0.00 0.10 0.00 0.00 66.02 64.74 1wfz s SER 2 CO 0.00 0.10 0.46 -0.44 0.98 0.00 0.00 173.24 174.34 1wfz s SER 3 N -2.87 -0.51 0.00 7.02 0.01 -1.26 -5.06 113.70 111.03 1wfz s SER 3 Ca 0.30 0.95 0.00 0.00 1.31 0.00 0.00 55.95 58.51 1wfz s SER 3 Cb -0.11 0.93 0.00 0.00 0.21 0.00 0.00 66.02 67.05 1wfz s SER 3 CO 0.23 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.31 1wfz n GLY 4 N 3.21 -2.37 3.19 3.44 0.00 -1.26 -5.15 105.19 106.24 1wfz n GLY 4 Ca -0.16 0.79 -0.35 0.00 0.00 0.00 0.00 46.02 46.30 1wfz n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wfz n SER 5 N -0.90 -4.03 -3.64 1.61 7.64 -1.26 -5.02 113.62 108.01 1wfz n SER 5 Ca 0.00 0.21 -0.04 0.00 1.01 0.00 0.00 58.87 60.05 1wfz n SER 5 Cb 0.00 -0.94 -0.07 0.00 -1.01 0.00 0.00 64.21 62.19 1wfz n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wfz s SER 6 N -1.47 -0.26 0.24 6.43 0.15 -1.26 -5.15 113.70 112.38 1wfz s SER 6 Ca 0.48 0.48 0.00 0.00 0.70 0.00 0.00 55.95 57.60 1wfz s SER 6 Cb -0.17 0.65 0.00 0.00 -1.71 0.00 0.00 66.02 64.79 1wfz s SER 6 CO 0.75 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.72 1wfz n GLY 7 N 2.30 -4.07 0.16 9.45 0.00 -1.26 -4.91 105.19 106.86 1wfz n GLY 7 Ca -0.13 -0.79 -0.08 0.00 0.00 0.00 0.00 46.02 45.02 1wfz n GLY 7 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1wfz h GLU 8 N 1.26 -0.30 -6.15 1.61 4.39 -2.06 -3.45 114.58 109.88 1wfz h GLU 8 Ca 0.00 0.02 -0.59 0.00 0.34 0.00 0.00 59.36 59.13 1wfz h GLU 8 Cb 0.00 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.67 1wfz h GLU 8 CO 0.00 -0.03 -0.12 1.21 -1.16 0.00 0.00 179.01 178.91 1wfz s ASN 9 N -5.29 6.89 0.86 1.42 2.47 -1.26 -5.08 114.94 114.96 1wfz s ASN 9 Ca -0.09 1.08 -0.11 0.00 0.42 0.00 0.00 52.86 54.16 1wfz s ASN 9 Cb 0.00 -2.29 0.11 0.00 -1.45 0.00 0.00 41.25 37.62 1wfz s ASN 9 CO 0.30 0.26 1.09 -2.16 -3.72 0.00 0.00 177.10 172.87 1wfz s PRO 10 N -1.29 1.56 -0.04 0.43 0.04 -1.26 -5.00 135.00 129.43 1wfz s PRO 10 Ca 0.29 0.92 -0.08 0.00 0.04 0.00 0.00 61.00 62.17 1wfz s PRO 10 Cb -0.17 -1.84 -0.29 0.00 0.04 0.00 0.00 34.50 32.24 1wfz s PRO 10 CO 0.17 -2.06 0.68 0.07 0.04 0.00 0.00 177.00 175.90 1wfz h ARG 11 N -1.42 0.33 -0.74 4.56 0.11 -1.99 -3.35 114.38 111.88 1wfz h ARG 11 Ca -0.48 -0.57 0.27 0.00 0.10 0.00 0.00 59.98 59.31 1wfz h ARG 11 Cb 1.27 0.21 -0.14 0.00 1.11 0.00 0.00 29.97 32.42 1wfz h ARG 11 CO 0.54 1.23 0.25 0.09 0.10 0.00 0.00 179.97 182.18 1wfz n ASN 12 N -3.52 0.13 -4.27 0.08 3.02 -1.26 -4.50 115.26 104.93 1wfz n ASN 12 Ca -0.23 1.25 -0.53 0.00 -0.03 0.00 0.00 54.58 55.03 1wfz n ASN 12 Cb 1.06 -0.55 -0.06 0.00 -0.61 0.00 0.00 39.78 39.62 1wfz n ASN 12 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1wfz n VAL 13 N -4.81 0.56 -3.17 2.41 0.31 -1.26 -4.59 118.33 107.78 1wfz n VAL 13 Ca 0.24 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1wfz n VAL 13 Cb 0.81 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.74 1wfz n VAL 13 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wfz n GLY 14 N 1.57 -0.54 3.55 2.92 0.00 -1.26 -4.98 105.19 106.45 1wfz n GLY 14 Ca 0.19 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 45.22 1wfz n GLY 14 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wfz s SER 15 N -4.00 -0.68 0.30 1.61 0.15 -1.26 -4.51 113.70 105.32 1wfz s SER 15 Ca 0.00 1.03 0.08 0.00 0.70 0.00 0.00 55.95 57.76 1wfz s SER 15 Cb 0.00 0.96 -0.04 0.00 -1.71 0.00 0.00 66.02 65.23 1wfz s SER 15 CO 0.00 -0.43 0.16 -0.76 1.20 0.00 0.00 173.24 173.41 1wfz s LEU 16 N -0.44 3.44 -0.36 3.45 1.43 -1.26 -5.04 118.68 119.89 1wfz s LEU 16 Ca -0.06 -0.57 -0.27 0.00 -1.03 0.00 0.00 54.13 52.20 1wfz s LEU 16 Cb -0.03 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 1wfz s LEU 16 CO 0.05 -0.19 2.09 -0.62 0.23 0.00 0.00 176.35 177.91 1wfz s ASP 17 N -3.84 5.33 0.47 2.29 2.15 -1.26 -4.81 116.67 116.99 1wfz s ASP 17 Ca 0.36 1.34 0.26 0.00 0.43 0.00 0.00 52.55 54.94 1wfz s ASP 17 Cb -0.05 -2.52 0.67 0.00 -0.30 0.00 0.00 42.92 40.72 1wfz s ASP 17 CO 0.23 -2.15 1.73 0.07 -0.17 0.00 0.00 175.17 174.88 1wfz h LYS 18 N 15.43 0.00 0.00 4.34 5.09 -1.94 -3.03 116.57 136.45 1wfz h LYS 18 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.41 1wfz h LYS 18 Cb 1.21 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.54 1wfz h LYS 18 CO 1.06 0.03 0.00 0.25 -2.09 0.00 0.00 179.45 178.70 1wfz n THR 19 N -3.12 0.95 -3.48 0.07 -2.24 -1.26 -4.72 114.28 100.49 1wfz n THR 19 Ca 0.03 0.24 -0.21 0.00 -2.27 0.00 0.00 64.05 61.84 1wfz n THR 19 Cb 0.47 -1.04 -0.01 0.00 -2.10 0.00 0.00 70.33 67.65 1wfz n THR 19 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1wfz s SER 20 N -2.80 6.08 -0.23 3.42 0.15 -1.15 -5.05 113.70 114.12 1wfz s SER 20 Ca 0.08 0.07 -0.11 0.00 0.70 0.00 0.00 55.95 56.69 1wfz s SER 20 Cb 0.08 -1.57 -0.18 0.00 -1.71 0.00 0.00 66.02 62.65 1wfz s SER 20 CO 0.20 -0.38 -0.04 2.29 1.20 0.00 0.00 173.24 176.52 1wfz n LYS 21 N -1.70 0.63 -0.17 5.44 2.85 -1.26 -4.23 118.16 119.72 1wfz n LYS 21 Ca -0.03 0.33 0.29 0.00 -1.05 0.00 0.00 58.31 57.85 1wfz n LYS 21 Cb 0.57 -1.61 0.64 0.00 -0.65 0.00 0.00 35.03 33.99 1wfz n LYS 21 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 177.40 174.40 1wfz h ASN 22 N -0.59 0.00 -3.48 -5.58 -1.07 -1.92 -3.33 115.58 99.61 1wfz h ASN 22 Ca -0.53 0.00 -0.67 0.00 0.07 0.00 0.00 56.30 55.17 1wfz h ASN 22 Cb 1.67 0.00 -0.30 0.00 -2.07 0.00 0.00 38.32 37.62 1wfz h ASN 22 CO -0.20 0.00 -0.72 0.54 0.07 0.00 0.00 177.43 177.12 1wfz s VAL 23 N -4.64 3.15 0.76 6.14 0.11 -1.26 -0.56 120.40 124.11 1wfz s VAL 23 Ca -0.04 -0.83 -0.10 0.00 -2.93 0.00 0.00 61.98 58.08 1wfz s VAL 23 Cb 0.17 -2.55 0.06 0.00 -1.53 0.00 0.00 36.38 32.53 1wfz s VAL 23 CO 0.60 0.25 1.11 -0.83 -3.33 0.00 0.00 175.10 172.90 1wfz s GLY 24 N 1.39 1.62 -0.24 6.54 0.00 -0.73 -4.72 107.32 111.18 1wfz s GLY 24 Ca 0.02 -0.69 -0.03 0.00 0.00 0.00 0.00 44.72 44.02 1wfz s GLY 24 CO -0.03 -0.25 0.09 -1.59 0.00 0.00 0.00 173.10 171.32 1wfz s THR 25 N -3.44 0.29 -0.34 0.90 2.01 -1.26 -3.24 115.64 110.56 1wfz s THR 25 Ca 0.61 -0.70 -0.05 0.00 0.31 0.00 0.00 61.69 61.86 1wfz s THR 25 Cb -0.11 -1.04 0.05 0.00 0.01 0.00 0.00 72.50 71.41 1wfz s THR 25 CO 0.48 -0.47 0.09 -0.83 -0.69 0.00 0.00 174.62 173.20 1wfz s GLY 26 N 1.94 1.84 -0.16 4.40 0.00 0.64 -4.65 107.32 111.32 1wfz s GLY 26 Ca 0.05 -1.83 -0.04 0.00 0.00 0.00 0.00 44.72 42.89 1wfz s GLY 26 CO -0.20 0.78 -0.03 -2.27 0.00 0.00 0.00 173.10 171.38 1wfz s LEU 27 N 1.34 3.29 -0.06 0.66 2.96 -1.26 0.34 118.68 125.95 1wfz s LEU 27 Ca -0.02 -0.11 -0.03 0.00 -0.22 0.00 0.00 54.13 53.75 1wfz s LEU 27 Cb -0.20 -1.80 0.03 0.00 0.50 0.00 0.00 46.19 44.73 1wfz s LEU 27 CO 0.01 0.17 0.13 0.68 -1.32 0.00 0.00 176.35 176.02 1wfz s VAL 28 N 0.36 -0.04 0.28 1.68 -7.23 -0.41 -4.96 120.40 110.08 1wfz s VAL 28 Ca -0.04 0.15 0.04 0.00 -1.81 0.00 0.00 61.98 60.32 1wfz s VAL 28 Cb -0.14 -0.21 -0.06 0.00 0.56 0.00 0.00 36.38 36.53 1wfz s VAL 28 CO 0.03 0.06 0.03 -0.83 -0.31 0.00 0.00 175.10 174.08 1wfz s GLY 29 N 0.93 1.81 -0.15 2.32 0.00 -1.25 -1.28 107.32 109.69 1wfz s GLY 29 Ca -0.07 -1.91 -0.11 0.00 0.00 0.00 0.00 44.72 42.62 1wfz s GLY 29 CO -0.04 -1.73 0.22 0.00 0.00 0.00 0.00 173.10 171.54 1wfz s ALA 30 N -3.37 3.68 -0.02 3.20 0.00 -0.45 -4.86 121.76 119.94 1wfz s ALA 30 Ca 0.33 -0.55 -0.25 0.00 0.00 0.00 0.00 51.96 51.49 1wfz s ALA 30 Cb 0.07 -2.24 -0.19 0.00 0.00 0.00 0.00 23.12 20.75 1wfz s ALA 30 CO 0.12 0.23 1.22 -1.00 0.00 0.00 0.00 175.76 176.34 1wfz h PRO 31 N 6.23 -0.07 0.10 0.00 0.13 -1.96 -0.04 132.00 136.38 1wfz h PRO 31 Ca -0.44 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1wfz h PRO 31 Cb 1.17 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1wfz h PRO 31 CO 0.72 0.39 -0.05 0.00 -0.23 0.00 0.00 178.00 178.83 1wfz h ALA 32 N 0.34 -0.49 -0.90 -0.56 0.00 -2.00 -3.31 119.26 112.33 1wfz h ALA 32 Ca -0.01 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1wfz h ALA 32 Cb 0.49 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 1wfz h ALA 32 CO 0.01 -0.48 0.58 0.00 0.00 0.00 0.00 179.25 179.36 1wfz n GLY 34 N -1.41 0.55 3.51 0.00 0.00 -0.06 -4.90 105.19 102.88 1wfz n GLY 34 Ca 0.16 -0.23 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 1wfz n GLY 34 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wfz s ASP 35 N -2.78 3.81 -0.31 1.61 1.01 -1.05 -4.73 116.67 114.23 1wfz s ASP 35 Ca 0.02 -0.89 -0.02 0.00 0.71 0.00 0.00 52.55 52.37 1wfz s ASP 35 Cb -0.00 -0.44 0.10 0.00 1.01 0.00 0.00 42.92 43.59 1wfz s ASP 35 CO 0.03 0.05 0.12 -0.69 0.21 0.00 0.00 175.17 174.89 1wfz s VAL 36 N -2.26 0.53 -0.40 -1.27 1.01 -0.51 -1.34 120.40 116.16 1wfz s VAL 36 Ca 0.28 -1.21 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 1wfz s VAL 36 Cb -0.06 -1.41 0.06 0.00 0.00 0.00 0.00 36.38 34.97 1wfz s VAL 36 CO 0.15 -0.71 0.23 -0.32 0.00 0.00 0.00 175.10 174.45 1wfz s MET 37 N 1.74 2.65 -0.46 2.72 1.75 -0.40 -1.52 119.30 125.78 1wfz s MET 37 Ca 0.10 -1.35 -0.18 0.00 -1.25 0.00 0.00 55.69 53.01 1wfz s MET 37 Cb -0.17 -3.73 0.04 0.00 2.84 0.00 0.00 34.83 33.81 1wfz s MET 37 CO -0.28 -0.87 0.54 0.21 -0.65 0.00 0.00 175.02 173.97 1wfz s LYS 38 N 1.45 3.12 0.03 4.11 2.20 0.10 -1.29 119.74 129.46 1wfz s LYS 38 Ca 0.02 -0.81 -0.07 0.00 -0.36 0.00 0.00 55.97 54.75 1wfz s LYS 38 Cb -0.22 -4.03 -0.05 0.00 -1.51 0.00 0.00 37.83 32.02 1wfz s LYS 38 CO 0.03 -1.04 0.30 -1.17 -0.36 0.00 0.00 175.35 173.11 1wfz s LEU 39 N 2.40 4.36 -0.17 5.43 2.96 0.15 -2.96 118.68 130.85 1wfz s LEU 39 Ca 0.14 0.62 -0.07 0.00 -0.22 0.00 0.00 54.13 54.60 1wfz s LEU 39 Cb -0.18 -2.76 0.08 0.00 0.50 0.00 0.00 46.19 43.83 1wfz s LEU 39 CO 0.13 0.23 0.38 -1.10 -1.32 0.00 0.00 176.35 174.67 1wfz s GLN 40 N -1.80 0.30 0.03 1.98 -0.21 -1.20 -0.26 119.66 118.49 1wfz s GLN 40 Ca 0.29 0.89 0.06 0.00 0.02 0.00 0.00 55.36 56.62 1wfz s GLN 40 Cb -0.13 0.15 -0.02 0.00 1.00 0.00 0.00 33.01 34.00 1wfz s GLN 40 CO 0.17 -0.23 -0.19 0.96 -2.12 0.00 0.00 175.29 173.88 1wfz s ILE 41 N 2.18 1.48 -0.29 1.08 -5.25 -1.20 -0.82 121.20 118.38 1wfz s ILE 41 Ca -0.04 -1.03 -0.10 0.00 -0.99 0.00 0.00 60.65 58.50 1wfz s ILE 41 Cb -0.11 -1.28 -0.02 0.00 2.95 0.00 0.00 42.46 44.00 1wfz s ILE 41 CO -0.12 0.22 0.15 -1.58 -1.79 0.00 0.00 174.94 171.83 1wfz s GLN 42 N -0.94 3.55 -0.03 0.37 0.74 0.36 -1.77 119.66 121.95 1wfz s GLN 42 Ca 0.06 -0.57 -0.13 0.00 0.05 0.00 0.00 55.36 54.76 1wfz s GLN 42 Cb -0.08 -3.56 -0.05 0.00 1.10 0.00 0.00 33.01 30.41 1wfz s GLN 42 CO 0.01 -0.32 0.35 0.08 -0.55 0.00 0.00 175.29 174.86 1wfz s VAL 43 N 1.66 5.13 0.64 1.34 1.01 0.28 -1.55 120.40 128.90 1wfz s VAL 43 Ca 0.06 0.71 -0.01 0.00 0.00 0.00 0.00 61.98 62.74 1wfz s VAL 43 Cb -0.16 -3.65 0.13 0.00 0.00 0.00 0.00 36.38 32.69 1wfz s VAL 43 CO 0.07 0.59 0.88 -0.67 0.00 0.00 0.00 175.10 175.96 1wfz n ASP 44 N 1.87 1.13 -0.19 3.32 -0.08 -1.02 -4.69 116.55 116.90 1wfz n ASP 44 Ca -0.15 -1.97 0.01 0.00 -1.51 0.00 0.00 54.79 51.17 1wfz n ASP 44 Cb 0.53 -0.57 0.27 0.00 2.34 0.00 0.00 41.12 43.69 1wfz n ASP 44 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 1wfz h GLU 45 N 0.00 0.92 0.00 -0.67 4.11 -1.99 -0.87 114.58 116.08 1wfz h GLU 45 Ca -0.29 -0.06 -0.04 0.00 0.07 0.00 0.00 59.36 59.04 1wfz h GLU 45 Cb 1.06 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 1wfz h GLU 45 CO 0.31 0.61 -0.20 0.87 0.07 0.00 0.00 179.01 180.67 1wfz h LYS 46 N 0.95 0.00 0.00 1.06 1.57 -2.04 -3.46 116.57 114.64 1wfz h LYS 46 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1wfz h LYS 46 Cb -0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.21 1wfz h LYS 46 CO -0.06 0.20 0.00 0.41 -0.57 0.00 0.00 179.45 179.43 1wfz n GLY 47 N 0.21 1.16 3.57 3.86 0.00 -0.33 -5.09 105.19 108.57 1wfz n GLY 47 Ca 0.00 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1wfz n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wfz s LYS 48 N -0.38 3.37 -0.20 1.61 2.36 -1.26 -3.03 119.74 122.22 1wfz s LYS 48 Ca 0.00 -0.48 -0.29 0.00 -2.55 0.00 0.00 55.97 52.65 1wfz s LYS 48 Cb 0.00 -2.85 -0.04 0.00 -1.05 0.00 0.00 37.83 33.89 1wfz s LYS 48 CO 0.00 0.43 1.82 0.42 1.55 0.00 0.00 175.35 179.58 1wfz s ILE 49 N -0.16 3.42 -0.15 5.43 1.01 -0.64 -2.43 121.20 127.68 1wfz s ILE 49 Ca 0.04 0.46 0.18 0.00 0.00 0.00 0.00 60.65 61.33 1wfz s ILE 49 Cb -0.13 -3.45 -0.26 0.00 0.01 0.00 0.00 42.46 38.64 1wfz s ILE 49 CO 0.02 -0.21 0.24 1.33 0.00 0.00 0.00 174.94 176.32 1wfz n VAL 50 N 6.70 1.10 -4.11 2.92 0.24 -0.60 -2.76 118.33 121.83 1wfz n VAL 50 Ca 0.22 -0.77 -0.14 0.00 -2.04 0.00 0.00 64.34 61.60 1wfz n VAL 50 Cb 0.45 -0.41 -0.13 0.00 -1.47 0.00 0.00 33.84 32.28 1wfz n VAL 50 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1wfz s ASP 51 N -5.34 0.81 -0.11 -1.34 1.01 -1.23 -4.89 116.67 105.58 1wfz s ASP 51 Ca -0.09 -0.39 -0.14 0.00 0.71 0.00 0.00 52.55 52.64 1wfz s ASP 51 Cb 0.08 -0.01 0.04 0.00 1.01 0.00 0.00 42.92 44.04 1wfz s ASP 51 CO 0.85 -0.10 0.38 0.00 0.21 0.00 0.00 175.17 176.50 1wfz s ALA 52 N -0.93 -0.94 0.11 5.23 0.00 -1.26 -0.49 121.76 123.49 1wfz s ALA 52 Ca -0.05 0.90 0.05 0.00 0.00 0.00 0.00 51.96 52.86 1wfz s ALA 52 Cb -0.07 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 1wfz s ALA 52 CO 0.00 -0.21 -0.13 1.03 0.00 0.00 0.00 175.76 176.45 1wfz s ARG 53 N -0.24 0.97 -0.05 0.00 1.81 -0.00 -4.96 118.95 116.48 1wfz s ARG 53 Ca -0.04 -1.21 -0.02 0.00 -1.72 0.00 0.00 55.73 52.74 1wfz s ARG 53 Cb -0.03 -0.81 0.03 0.00 -0.45 0.00 0.00 34.95 33.69 1wfz s ARG 53 CO 0.02 0.15 0.05 -0.59 -0.68 0.00 0.00 175.30 174.25 1wfz s PHE 54 N -2.19 0.19 -0.33 -0.53 -0.12 -1.26 -3.22 117.98 110.52 1wfz s PHE 54 Ca 0.08 0.14 -0.00 0.00 -0.05 0.00 0.00 56.93 57.10 1wfz s PHE 54 Cb -0.05 -0.56 0.11 0.00 -0.63 0.00 0.00 43.02 41.90 1wfz s PHE 54 CO 0.02 -0.23 0.12 0.21 -0.05 0.00 0.00 175.22 175.29 1wfz s LYS 55 N 2.13 0.84 0.05 1.99 2.47 -1.15 -4.43 119.74 121.64 1wfz s LYS 55 Ca 0.05 -1.28 0.00 0.00 -1.56 0.00 0.00 55.97 53.18 1wfz s LYS 55 Cb -0.12 -2.10 -0.04 0.00 -1.46 0.00 0.00 37.83 34.11 1wfz s LYS 55 CO -0.04 -1.02 0.17 0.99 0.16 0.00 0.00 175.35 175.61 1wfz s THR 56 N 1.36 5.14 -0.21 3.43 2.01 -1.26 -0.72 115.64 125.39 1wfz s THR 56 Ca 0.11 -0.45 -0.04 0.00 0.31 0.00 0.00 61.69 61.63 1wfz s THR 56 Cb -0.19 -3.48 0.07 0.00 0.01 0.00 0.00 72.50 68.92 1wfz s THR 56 CO -0.19 0.17 0.07 -0.36 -0.69 0.00 0.00 174.62 173.62 1wfz s PHE 57 N -1.43 0.71 0.00 4.92 0.08 -0.57 -4.93 117.98 116.75 1wfz s PHE 57 Ca 0.32 -0.76 0.00 0.00 0.12 0.00 0.00 56.93 56.60 1wfz s PHE 57 Cb -0.13 -0.96 0.00 0.00 -0.57 0.00 0.00 43.02 41.36 1wfz s PHE 57 CO 0.24 -0.64 0.00 0.41 -0.10 0.00 0.00 175.22 175.14 1wfz n GLY 58 N 5.14 0.36 3.50 4.36 0.00 -1.26 -1.42 105.19 115.86 1wfz n GLY 58 Ca -0.07 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 1wfz n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wfz h GLY 60 N -2.62 -0.16 -1.29 0.00 0.00 -2.00 -3.24 103.07 93.77 1wfz h GLY 60 Ca -0.60 0.06 0.41 0.00 0.00 0.00 0.00 47.33 47.19 1wfz h GLY 60 CO 0.49 -0.06 0.89 -1.14 0.00 0.00 0.00 176.54 176.72 1wfz n SER 61 N -4.85 0.09 -0.03 0.19 3.41 -1.26 0.21 113.62 111.38 1wfz n SER 61 Ca -0.06 0.93 -0.15 0.00 -0.26 0.00 0.00 58.87 59.34 1wfz n SER 61 Cb 0.22 -0.46 -0.11 0.00 -0.26 0.00 0.00 64.21 63.60 1wfz n SER 61 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wfz h ALA 62 N 1.01 0.04 -0.73 7.33 0.00 -1.92 -2.50 119.26 122.50 1wfz h ALA 62 Ca 0.71 -0.42 0.03 0.00 0.00 0.00 0.00 54.91 55.23 1wfz h ALA 62 Cb 2.56 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 20.31 1wfz h ALA 62 CO -0.19 0.03 0.46 0.82 0.00 0.00 0.00 179.25 180.36 1wfz h ILE 63 N -0.50 1.10 0.13 0.00 2.04 0.25 -2.34 117.51 118.19 1wfz h ILE 63 Ca -0.02 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1wfz h ILE 63 Cb 0.90 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1wfz h ILE 63 CO 0.04 0.16 -0.06 0.00 0.00 0.00 0.00 178.15 178.28 1wfz h ALA 64 N 1.31 -0.81 -0.85 1.87 0.00 -1.27 -1.90 119.26 117.62 1wfz h ALA 64 Ca 0.29 -0.04 0.23 0.00 0.00 0.00 0.00 54.91 55.39 1wfz h ALA 64 Cb 0.03 0.07 -0.16 0.00 0.00 0.00 0.00 17.79 17.73 1wfz h ALA 64 CO -0.11 -0.79 0.00 0.43 0.00 0.00 0.00 179.25 178.78 1wfz n SER 65 N -2.59 -0.11 0.28 0.00 7.64 -0.94 0.34 113.62 118.24 1wfz n SER 65 Ca -0.02 1.44 -0.16 0.00 1.01 0.00 0.00 58.87 61.13 1wfz n SER 65 Cb 0.07 -0.52 -0.08 0.00 -1.01 0.00 0.00 64.21 62.67 1wfz n SER 65 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1wfz h SER 66 N 0.00 -0.58 -0.95 6.43 0.02 -1.42 -0.55 113.55 116.50 1wfz h SER 66 Ca 0.51 -0.01 0.25 0.00 -0.84 0.00 0.00 61.79 61.70 1wfz h SER 66 Cb 1.03 0.15 -0.13 0.00 0.14 0.00 0.00 62.40 63.59 1wfz h SER 66 CO -0.80 -0.36 0.47 0.77 -1.14 0.00 0.00 176.83 175.77 1wfz h SER 67 N -0.75 0.43 -0.30 3.07 4.64 0.74 0.38 113.55 121.76 1wfz h SER 67 Ca -0.07 0.16 -0.16 0.00 -0.47 0.00 0.00 61.79 61.25 1wfz h SER 67 Cb 0.55 0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1wfz h SER 67 CO 0.11 -0.02 -0.45 0.25 -0.87 0.00 0.00 176.83 175.86 1wfz h LEU 68 N 0.41 0.92 0.62 5.97 6.46 -1.00 -3.05 115.31 125.64 1wfz h LEU 68 Ca 0.62 -0.51 -0.03 0.00 -0.12 0.00 0.00 57.88 57.84 1wfz h LEU 68 Cb 1.24 -0.26 0.01 0.00 -0.73 0.00 0.00 40.66 40.92 1wfz h LEU 68 CO -0.54 1.25 -0.30 0.00 -0.62 0.00 0.00 178.44 178.23 1wfz h ALA 69 N 0.70 -0.94 -0.84 1.25 0.00 0.11 -1.68 119.26 117.85 1wfz h ALA 69 Ca 0.03 -0.18 0.24 0.00 0.00 0.00 0.00 54.91 55.00 1wfz h ALA 69 Cb 1.05 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 19.13 1wfz h ALA 69 CO 0.10 -0.88 0.90 0.00 0.00 0.00 0.00 179.25 179.37 1wfz h THR 70 N -1.06 0.17 0.04 0.00 1.03 -0.55 1.32 112.91 113.86 1wfz h THR 70 Ca -0.08 0.00 -0.27 0.00 -0.01 0.00 0.00 66.41 66.05 1wfz h THR 70 Cb 0.63 0.29 -0.03 0.00 -1.07 0.00 0.00 68.15 67.97 1wfz h THR 70 CO 0.14 0.00 -1.40 -0.08 -0.01 0.00 0.00 175.52 174.17 1wfz h GLU 71 N 0.00 0.08 -0.31 0.00 4.81 -1.40 -3.30 114.58 114.46 1wfz h GLU 71 Ca 0.40 -0.13 -0.16 0.00 -0.13 0.00 0.00 59.36 59.33 1wfz h GLU 71 Cb 2.19 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 31.62 1wfz h GLU 71 CO -0.00 0.87 -0.45 -1.49 -0.73 0.00 0.00 179.01 177.21 1wfz h TRP 72 N 0.02 1.05 0.00 0.92 4.06 0.26 -2.99 115.95 119.28 1wfz h TRP 72 Ca -0.17 -0.35 -0.01 0.00 2.06 0.00 0.00 58.89 60.42 1wfz h TRP 72 Cb 1.93 -0.21 -0.00 0.00 -1.00 0.00 0.00 29.16 29.88 1wfz h TRP 72 CO 0.02 1.16 -0.05 -0.39 -3.56 0.00 0.00 178.44 175.62 1wfz h VAL 73 N 0.63 0.82 -3.33 1.49 -1.51 -1.35 -3.40 116.25 109.59 1wfz h VAL 73 Ca 0.03 -0.19 -0.53 0.00 -1.23 0.00 0.00 66.70 64.79 1wfz h VAL 73 Cb 1.05 1.11 0.05 0.00 -2.13 0.00 0.00 31.29 31.37 1wfz h VAL 73 CO 0.10 0.05 0.76 -0.54 -1.23 0.00 0.00 177.57 176.72 1wfz s LYS 74 N -4.74 4.27 0.00 5.19 1.02 -1.13 -2.47 119.74 121.89 1wfz s LYS 74 Ca -0.05 2.29 0.00 0.00 0.02 0.00 0.00 55.97 58.24 1wfz s LYS 74 Cb 0.16 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 34.35 1wfz s LYS 74 CO 0.62 -0.43 0.00 0.41 -0.92 0.00 0.00 175.35 175.04 1wfz n GLY 75 N 2.34 2.70 3.96 -3.33 0.00 -1.11 -5.01 105.19 104.74 1wfz n GLY 75 Ca 0.07 -0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 1wfz n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wfz s LYS 76 N 0.00 2.60 0.25 1.61 1.02 -1.03 -4.82 119.74 119.37 1wfz s LYS 76 Ca 0.00 -0.66 0.02 0.00 0.02 0.00 0.00 55.97 55.35 1wfz s LYS 76 Cb 0.00 -2.46 -0.04 0.00 -0.52 0.00 0.00 37.83 34.82 1wfz s LYS 76 CO 0.00 -0.70 0.42 0.95 -0.92 0.00 0.00 175.35 175.10 1wfz s THR 77 N -2.79 5.20 0.33 2.17 -4.23 -1.26 -1.62 115.64 113.43 1wfz s THR 77 Ca 0.56 -0.60 0.10 0.00 -1.18 0.00 0.00 61.69 60.57 1wfz s THR 77 Cb -0.10 -3.81 0.33 0.00 1.34 0.00 0.00 72.50 70.26 1wfz s THR 77 CO 0.39 -0.33 1.64 -0.37 -0.54 0.00 0.00 174.62 175.41 1wfz h VAL 78 N 1.20 0.23 -0.81 2.29 -1.51 -1.91 0.63 116.25 116.37 1wfz h VAL 78 Ca -0.50 -0.07 0.01 0.00 -1.23 0.00 0.00 66.70 64.91 1wfz h VAL 78 Cb 1.21 0.00 -0.04 0.00 -2.13 0.00 0.00 31.29 30.33 1wfz h VAL 78 CO 0.64 0.04 0.53 -0.33 -1.23 0.00 0.00 177.57 177.22 1wfz h GLU 79 N 0.21 1.06 0.30 5.19 5.08 -1.94 -2.32 114.58 122.15 1wfz h GLU 79 Ca 0.68 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.96 1wfz h GLU 79 Cb 1.54 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1wfz h GLU 79 CO -0.68 0.70 -0.14 0.93 -1.00 0.00 0.00 179.01 178.82 1wfz h GLU 80 N 1.09 -0.39 -1.00 2.33 4.39 -0.14 -2.80 114.58 118.07 1wfz h GLU 80 Ca 0.30 0.03 0.20 0.00 0.34 0.00 0.00 59.36 60.22 1wfz h GLU 80 Cb -0.11 0.09 -0.10 0.00 -0.10 0.00 0.00 28.75 28.52 1wfz h GLU 80 CO -0.07 -0.20 0.61 0.00 -1.16 0.00 0.00 179.01 178.19 1wfz h ALA 81 N 0.19 1.74 -0.11 3.43 0.00 -1.20 0.43 119.26 123.74 1wfz h ALA 81 Ca -0.04 0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1wfz h ALA 81 Cb 0.37 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1wfz h ALA 81 CO 0.07 -0.11 0.20 -0.07 0.00 0.00 0.00 179.25 179.34 1wfz h LEU 82 N 0.72 0.00 0.00 0.00 -0.00 -1.14 0.21 115.31 115.10 1wfz h LEU 82 Ca 0.58 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 58.32 1wfz h LEU 82 Cb 0.95 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.59 1wfz h LEU 82 CO -0.37 0.00 -0.86 0.71 -0.00 0.00 0.00 178.44 177.92 1wfz h THR 83 N 0.00 0.77 -1.70 0.22 1.35 -0.15 -3.45 112.91 109.95 1wfz h THR 83 Ca 0.05 -2.20 -0.62 0.00 -0.55 0.00 0.00 66.41 63.09 1wfz h THR 83 Cb 0.46 2.30 -0.00 0.00 -1.73 0.00 0.00 68.15 69.18 1wfz h THR 83 CO -0.00 0.44 1.38 -0.38 -0.25 0.00 0.00 175.52 176.71 1wfz n ILE 84 N -3.11 0.36 -2.62 6.82 5.41 0.73 -4.95 119.36 122.00 1wfz n ILE 84 Ca -0.02 -0.31 -0.23 0.00 1.00 0.00 0.00 62.75 63.19 1wfz n ILE 84 Cb 0.78 -2.11 0.10 0.00 -0.71 0.00 0.00 39.64 37.70 1wfz n ILE 84 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1wfz s LYS 85 N 5.79 1.80 -0.18 0.38 1.02 -1.26 -4.88 119.74 122.40 1wfz s LYS 85 Ca 1.02 -1.11 -0.17 0.00 0.02 0.00 0.00 55.97 55.73 1wfz s LYS 85 Cb -0.58 -2.36 -0.21 0.00 -0.52 0.00 0.00 37.83 34.15 1wfz s LYS 85 CO 0.43 -1.35 0.25 0.27 -0.92 0.00 0.00 175.35 174.04 1wfz n ASN 86 N -2.75 1.95 -0.35 2.83 0.23 -1.26 -3.94 115.26 111.96 1wfz n ASN 86 Ca 0.14 0.35 0.27 0.00 -0.53 0.00 0.00 54.58 54.82 1wfz n ASN 86 Cb 0.61 -0.93 0.52 0.00 -2.08 0.00 0.00 39.78 37.89 1wfz n ASN 86 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1wfz h THR 87 N -0.67 0.25 0.58 5.53 1.03 -1.97 -0.19 112.91 117.47 1wfz h THR 87 Ca -0.38 -0.08 -0.03 0.00 -0.01 0.00 0.00 66.41 65.91 1wfz h THR 87 Cb 1.54 -0.02 0.01 0.00 -1.07 0.00 0.00 68.15 68.60 1wfz h THR 87 CO -0.12 0.05 -0.28 -0.78 -0.01 0.00 0.00 175.52 174.38 1wfz h ASP 88 N 0.25 -0.66 -0.59 0.00 3.58 -1.96 -3.18 116.42 113.86 1wfz h ASP 88 Ca 0.76 -0.03 0.08 0.00 0.42 0.00 0.00 57.03 58.25 1wfz h ASP 88 Cb 1.89 0.17 -0.10 0.00 1.72 0.00 0.00 39.33 43.01 1wfz h ASP 88 CO -0.57 -0.29 -0.47 0.40 -2.88 0.00 0.00 179.24 175.43 1wfz h ILE 89 N -1.08 0.06 -0.98 2.25 2.04 -1.18 0.56 117.51 119.17 1wfz h ILE 89 Ca -0.08 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.03 1wfz h ILE 89 Cb 0.65 0.06 -0.18 0.00 -0.74 0.00 0.00 36.82 36.60 1wfz h ILE 89 CO 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 178.15 178.23 1wfz h ALA 90 N 0.49 1.01 0.58 1.87 0.00 -1.41 -0.23 119.26 121.57 1wfz h ALA 90 Ca 0.16 0.35 -0.02 0.00 0.00 0.00 0.00 54.91 55.40 1wfz h ALA 90 Cb 0.56 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1wfz h ALA 90 CO -0.70 -0.51 -0.43 -0.22 0.00 0.00 0.00 179.25 177.39 1wfz h LYS 91 N 0.01 -0.93 -0.79 0.00 3.64 -0.87 1.49 116.57 119.11 1wfz h LYS 91 Ca 0.56 0.06 0.14 0.00 -1.27 0.00 0.00 60.65 60.15 1wfz h LYS 91 Cb 1.07 0.21 -0.14 0.00 -0.41 0.00 0.00 32.23 32.96 1wfz h LYS 91 CO -0.95 -0.62 -0.25 0.39 -2.27 0.00 0.00 179.45 175.75 1wfz n GLU 92 N -5.08 -0.12 0.15 1.90 -0.58 -0.13 0.23 120.64 117.02 1wfz n GLU 92 Ca -0.12 1.23 0.08 0.00 -0.42 0.00 0.00 57.16 57.93 1wfz n GLU 92 Cb 0.42 -1.83 0.07 0.00 -0.57 0.00 0.00 31.44 29.52 1wfz n GLU 92 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1wfz h LEU 93 N 0.00 0.00 -1.56 -4.62 -0.00 -1.24 -3.48 115.31 104.40 1wfz h LEU 93 Ca 0.33 0.00 -0.30 0.00 -0.00 0.00 0.00 57.88 57.91 1wfz h LEU 93 Cb 0.53 0.00 0.15 0.00 -0.00 0.00 0.00 40.66 41.34 1wfz h LEU 93 CO -0.80 0.21 -0.67 0.00 -0.00 0.00 0.00 178.44 177.18 1wfz s LEU 95 N -5.96 3.84 1.02 0.00 0.05 -0.92 -5.01 118.68 111.70 1wfz s LEU 95 Ca 0.08 1.27 -0.13 0.00 0.05 0.00 0.00 54.13 55.40 1wfz s LEU 95 Cb -0.04 -4.14 0.20 0.00 -2.05 0.00 0.00 46.19 40.17 1wfz s LEU 95 CO 0.64 -0.39 1.09 -2.16 -0.55 0.00 0.00 176.35 174.98 1wfz s PRO 96 N -3.69 0.23 0.23 1.48 0.04 -1.26 -4.91 135.00 127.11 1wfz s PRO 96 Ca 0.54 0.45 0.22 0.00 0.04 0.00 0.00 61.00 62.25 1wfz s PRO 96 Cb -0.10 -1.72 0.94 0.00 0.04 0.00 0.00 34.50 33.66 1wfz s PRO 96 CO 0.28 -2.85 1.68 -0.35 0.04 0.00 0.00 177.00 175.79 1wfz n PRO 97 N -4.25 0.17 0.07 0.56 -0.04 -1.26 -2.57 135.00 127.67 1wfz n PRO 97 Ca 0.05 0.41 -0.12 0.00 -0.04 0.00 0.00 63.50 63.80 1wfz n PRO 97 Cb 0.58 -1.83 -0.13 0.00 -0.04 0.00 0.00 33.50 32.07 1wfz n PRO 97 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1wfz h VAL 98 N 0.00 1.44 -0.62 0.52 3.04 -2.05 -3.27 116.25 115.31 1wfz h VAL 98 Ca 0.00 -3.11 -0.19 0.00 -1.01 0.00 0.00 66.70 62.39 1wfz h VAL 98 Cb 0.34 2.82 -0.11 0.00 -2.01 0.00 0.00 31.29 32.33 1wfz h VAL 98 CO 0.00 0.87 0.24 0.29 -1.01 0.00 0.00 177.57 177.96 1wfz n LYS 99 N -3.40 3.18 -0.22 4.17 4.76 -1.06 -4.46 118.16 121.13 1wfz n LYS 99 Ca -0.08 -2.50 -0.06 0.00 -2.87 0.00 0.00 58.31 52.80 1wfz n LYS 99 Cb 1.00 -2.05 0.04 0.00 -1.84 0.00 0.00 35.03 32.18 1wfz n LYS 99 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1wfz h LEU 100 N 2.21 0.76 -1.32 -0.35 3.38 -1.61 -2.55 115.31 115.83 1wfz h LEU 100 Ca 0.24 -0.07 0.45 0.00 0.09 0.00 0.00 57.88 58.58 1wfz h LEU 100 Cb 2.08 -0.19 -0.12 0.00 0.09 0.00 0.00 40.66 42.52 1wfz h LEU 100 CO 0.63 0.61 0.87 0.00 0.09 0.00 0.00 178.44 180.63 1wfz n HIS 101 N -4.59 0.56 -0.03 1.13 1.44 -1.26 0.15 115.22 112.61 1wfz n HIS 101 Ca 0.05 0.56 -0.14 0.00 -2.01 0.00 0.00 57.72 56.18 1wfz n HIS 101 Cb 0.06 -0.99 -0.10 0.00 0.12 0.00 0.00 29.99 29.09 1wfz n HIS 101 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1wfz h SER 103 N -0.35 0.57 0.65 0.00 4.64 0.13 0.78 113.55 119.97 1wfz h SER 103 Ca -0.01 0.08 -0.27 0.00 -0.47 0.00 0.00 61.79 61.12 1wfz h SER 103 Cb 0.79 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.83 1wfz h SER 103 CO 0.03 0.18 -1.39 0.00 -0.87 0.00 0.00 176.83 174.78 1wfz h MET 104 N 0.54 0.10 -0.90 4.77 -0.00 -1.41 -3.32 114.93 114.71 1wfz h MET 104 Ca 0.56 -0.17 0.09 0.00 -0.00 0.00 0.00 59.70 60.17 1wfz h MET 104 Cb 1.19 0.06 -0.06 0.00 -0.00 0.00 0.00 31.60 32.79 1wfz h MET 104 CO -0.30 0.92 0.58 1.25 -0.00 0.00 0.00 176.91 179.36 1wfz h LEU 105 N 0.03 0.84 -0.42 -0.10 5.85 0.70 0.41 115.31 122.61 1wfz h LEU 105 Ca -0.17 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.49 1wfz h LEU 105 Cb 1.93 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.79 1wfz h LEU 105 CO 0.13 0.51 -0.05 0.00 -0.34 0.00 0.00 178.44 178.69 1wfz h ALA 106 N 1.54 0.58 0.06 1.25 0.00 -1.46 -1.97 119.26 119.26 1wfz h ALA 106 Ca 0.41 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1wfz h ALA 106 Cb 0.34 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1wfz h ALA 106 CO -0.17 0.41 -0.03 1.49 0.00 0.00 0.00 179.25 180.95 1wfz h GLU 107 N 0.61 -0.07 -0.59 0.00 4.81 -1.43 -2.60 114.58 115.31 1wfz h GLU 107 Ca 0.11 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.43 1wfz h GLU 107 Cb 0.56 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.89 1wfz h GLU 107 CO 0.03 0.23 0.23 0.22 -0.73 0.00 0.00 179.01 178.99 1wfz h ASP 108 N -0.38 0.26 -0.22 1.04 3.58 -0.97 -2.12 116.42 117.60 1wfz h ASP 108 Ca -0.01 0.07 0.04 0.00 0.42 0.00 0.00 57.03 57.55 1wfz h ASP 108 Cb 0.34 0.04 -0.04 0.00 1.72 0.00 0.00 39.33 41.38 1wfz h ASP 108 CO 0.01 0.16 -0.03 0.00 -2.88 0.00 0.00 179.24 176.50 1wfz h ALA 109 N 1.39 0.17 0.18 -0.78 0.00 -1.31 -1.52 119.26 117.39 1wfz h ALA 109 Ca 0.29 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 1wfz h ALA 109 Cb 0.32 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1wfz h ALA 109 CO -0.27 -0.45 -0.28 0.82 0.00 0.00 0.00 179.25 179.06 1wfz h ILE 110 N 0.03 0.00 -0.65 0.00 2.04 -1.00 -1.86 117.51 116.07 1wfz h ILE 110 Ca 0.11 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.08 1wfz h ILE 110 Cb 0.15 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.11 1wfz h ILE 110 CO -0.21 0.00 -0.34 0.11 0.00 0.00 0.00 178.15 177.71 1wfz h LYS 111 N -0.49 -0.14 -0.97 2.37 6.56 -1.36 0.30 116.57 122.85 1wfz h LYS 111 Ca -0.02 0.01 0.25 0.00 -1.06 0.00 0.00 60.65 59.83 1wfz h LYS 111 Cb 0.45 0.03 -0.13 0.00 -0.57 0.00 0.00 32.23 32.01 1wfz h LYS 111 CO -0.09 -0.09 0.53 0.00 -2.06 0.00 0.00 179.45 177.74 1wfz h ALA 112 N 1.04 1.71 -0.15 3.86 0.00 -1.05 0.17 119.26 124.83 1wfz h ALA 112 Ca 0.25 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1wfz h ALA 112 Cb 0.56 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1wfz h ALA 112 CO -0.72 -0.34 0.00 0.00 0.00 0.00 0.00 179.25 178.19 1wfz n ALA 113 N -2.37 -0.46 -0.15 0.00 0.00 0.10 -1.36 120.51 116.27 1wfz n ALA 113 Ca 0.26 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.64 1wfz n ALA 113 Cb 0.76 0.01 -0.00 0.00 0.00 0.00 0.00 19.45 20.22 1wfz n ALA 113 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1wfz h LEU 114 N 0.00 -1.08 -0.05 0.00 -0.00 -1.15 -1.64 115.31 111.39 1wfz h LEU 114 Ca 0.00 0.20 0.01 0.00 -0.00 0.00 0.00 57.88 58.09 1wfz h LEU 114 Cb 0.00 0.52 -0.01 0.00 -0.00 0.00 0.00 40.66 41.17 1wfz h LEU 114 CO 0.00 -0.31 -0.08 0.00 -0.00 0.00 0.00 178.44 178.05 1wfz h ALA 115 N 0.90 -0.41 -0.94 1.53 0.00 -1.00 0.10 119.26 119.43 1wfz h ALA 115 Ca 0.20 -0.00 0.27 0.00 0.00 0.00 0.00 54.91 55.37 1wfz h ALA 115 Cb 0.54 0.73 -0.17 0.00 0.00 0.00 0.00 17.79 18.89 1wfz h ALA 115 CO -0.59 -0.45 0.11 0.22 0.00 0.00 0.00 179.25 178.54 1wfz h ASP 116 N -0.07 -0.30 -0.78 0.00 3.58 -0.88 0.78 116.42 118.74 1wfz h ASP 116 Ca 0.01 0.25 0.00 0.00 0.42 0.00 0.00 57.03 57.72 1wfz h ASP 116 Cb 0.09 0.41 -0.04 0.00 1.72 0.00 0.00 39.33 41.52 1wfz h ASP 116 CO -0.08 -0.30 0.50 0.22 -2.88 0.00 0.00 179.24 176.70 1wfz h TYR 117 N 0.06 0.99 -0.35 0.28 3.20 -0.26 -2.70 116.97 118.19 1wfz h TYR 117 Ca 0.59 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.45 1wfz h TYR 117 Cb 1.24 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 1wfz h TYR 117 CO -0.40 0.64 0.10 0.87 -1.64 0.00 0.00 178.16 177.72 1wfz h LYS 118 N 1.06 0.56 -0.71 1.82 1.57 0.30 -2.97 116.57 118.19 1wfz h LYS 118 Ca 0.28 -0.13 0.15 0.00 -1.87 0.00 0.00 60.65 59.09 1wfz h LYS 118 Cb -0.10 -0.08 -0.13 0.00 0.08 0.00 0.00 32.23 32.00 1wfz h LYS 118 CO -0.06 0.59 -0.12 -0.07 -0.57 0.00 0.00 179.45 179.22 1wfz h LEU 119 N 0.42 -0.56 -0.99 2.94 3.38 -0.72 0.30 115.31 120.08 1wfz h LEU 119 Ca 0.11 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1wfz h LEU 119 Cb 0.28 0.41 -0.05 0.00 0.09 0.00 0.00 40.66 41.39 1wfz h LEU 119 CO -0.00 -0.22 0.63 0.11 0.09 0.00 0.00 178.44 179.05 1wfz h LYS 120 N 0.03 1.32 -0.51 1.13 1.57 -1.41 -2.07 116.57 116.62 1wfz h LYS 120 Ca 0.36 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 59.01 1wfz h LYS 120 Cb 0.57 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1wfz h LYS 120 CO -0.70 0.89 0.20 1.96 -0.57 0.00 0.00 179.45 181.23 1wfz h GLN 121 N 1.35 0.74 0.19 3.15 1.08 -0.33 -3.11 115.11 118.16 1wfz h GLN 121 Ca 0.36 -0.11 0.01 0.00 -1.45 0.00 0.00 58.65 57.46 1wfz h GLN 121 Cb -0.12 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 27.14 1wfz h GLN 121 CO -0.07 0.61 -0.47 0.93 -0.95 0.00 0.00 178.83 178.88 1wfz h GLU 122 N 0.73 -0.70 -5.94 1.46 4.39 -0.37 -3.39 114.58 110.76 1wfz h GLU 122 Ca 0.17 0.05 -0.57 0.00 0.34 0.00 0.00 59.36 59.35 1wfz h GLU 122 Cb 0.15 0.16 -0.07 0.00 -0.10 0.00 0.00 28.75 28.90 1wfz h GLU 122 CO -0.02 -0.47 0.18 0.45 -1.16 0.00 0.00 179.01 177.99 1wfz s SER 123 N -4.35 6.92 0.17 1.42 0.15 -1.18 -5.06 113.70 111.78 1wfz s SER 123 Ca -0.15 1.12 0.09 0.00 0.70 0.00 0.00 55.95 57.71 1wfz s SER 123 Cb 0.05 -2.41 -0.04 0.00 -1.71 0.00 0.00 66.02 61.91 1wfz s SER 123 CO 0.54 -0.22 -0.14 -1.59 1.20 0.00 0.00 173.24 173.03 1wfz s LYS 124 N 1.37 1.91 -1.28 5.44 0.00 -1.26 -4.68 119.74 121.25 1wfz s LYS 124 Ca 0.36 -1.30 -0.12 0.00 0.00 0.00 0.00 55.97 54.91 1wfz s LYS 124 Cb -0.17 -2.10 0.12 0.00 0.00 0.00 0.00 37.83 35.69 1wfz s LYS 124 CO 0.15 0.44 0.31 0.43 0.00 0.00 0.00 175.35 176.68 1wfz n SER 125 N 0.23 -0.75 0.00 0.03 7.64 -1.26 -4.84 113.62 114.66 1wfz n SER 125 Ca -0.12 -0.90 0.00 0.00 1.01 0.00 0.00 58.87 58.86 1wfz n SER 125 Cb 0.55 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 1wfz n SER 125 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wfz n GLY 126 N -1.24 7.25 2.81 0.23 0.00 -1.26 -5.15 105.19 107.82 1wfz n GLY 126 Ca -0.00 -1.97 -0.24 0.00 0.00 0.00 0.00 46.02 43.80 1wfz n GLY 126 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wfz n PRO 127 N 0.00 -2.73 -4.52 1.61 -0.04 -1.26 -5.06 135.00 123.00 1wfz n PRO 127 Ca 0.00 -1.40 -0.31 0.00 -0.04 0.00 0.00 63.50 61.75 1wfz n PRO 127 Cb 0.00 -1.31 -0.17 0.00 -0.04 0.00 0.00 33.50 31.98 1wfz n PRO 127 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1wfz s SER 128 N -3.87 2.81 0.27 3.54 1.04 -1.26 -5.04 113.70 111.19 1wfz s SER 128 Ca 0.57 -0.53 -0.20 0.00 0.48 0.00 0.00 55.95 56.27 1wfz s SER 128 Cb -0.06 -1.28 -0.14 0.00 0.10 0.00 0.00 66.02 64.64 1wfz s SER 128 CO 0.44 0.04 0.23 -0.24 0.98 0.00 0.00 173.24 174.69 1wfz n SER 129 N 4.19 -1.87 0.00 7.02 2.88 -1.26 -5.30 113.62 119.28 1wfz n SER 129 Ca -0.19 0.80 0.11 0.00 -1.33 0.00 0.00 58.87 58.26 1wfz n SER 129 Cb 0.51 -0.77 0.64 0.00 -0.75 0.00 0.00 64.21 63.83 1wfz n SER 129 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42