#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 4.78 -0.23 1.61 1.04 -1.26 -5.06 113.70 114.57 1wfz s SER 2 Ca 0.00 -0.70 -0.30 0.00 0.48 0.00 0.00 55.95 55.43 1wfz s SER 2 Cb 0.00 -1.80 0.16 0.00 0.10 0.00 0.00 66.02 64.49 1wfz s SER 2 CO 0.00 -0.14 1.21 -0.55 0.98 0.00 0.00 173.24 174.74 1wfz s SER 3 N 1.45 -0.17 0.00 7.02 0.15 -1.26 -5.13 113.70 115.76 1wfz s SER 3 Ca 0.02 0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.85 1wfz s SER 3 Cb -0.17 0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.28 1wfz s SER 3 CO -0.00 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.88 1wfz n GLY 4 N 0.56 0.94 3.67 9.45 0.00 -1.26 -5.16 105.19 113.40 1wfz n GLY 4 Ca -0.04 -0.70 -0.26 0.00 0.00 0.00 0.00 46.02 45.03 1wfz n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wfz s SER 5 N 0.00 4.20 -0.30 1.61 0.01 -1.26 -5.12 113.70 112.85 1wfz s SER 5 Ca 0.00 -1.13 0.03 0.00 1.31 0.00 0.00 55.95 56.16 1wfz s SER 5 Cb 0.00 -0.47 0.08 0.00 0.21 0.00 0.00 66.02 65.84 1wfz s SER 5 CO 0.00 -0.43 -0.01 -0.55 0.41 0.00 0.00 173.24 172.66 1wfz s SER 6 N -3.80 4.44 0.00 2.44 0.15 -1.26 -4.81 113.70 110.87 1wfz s SER 6 Ca 0.38 -1.72 0.00 0.00 0.70 0.00 0.00 55.95 55.31 1wfz s SER 6 Cb 0.04 -1.45 0.00 0.00 -1.71 0.00 0.00 66.02 62.90 1wfz s SER 6 CO 0.20 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.95 1wfz n GLY 7 N 4.44 0.45 0.24 9.45 0.00 -1.26 -5.09 105.19 113.41 1wfz n GLY 7 Ca -0.05 -0.28 -0.08 0.00 0.00 0.00 0.00 46.02 45.61 1wfz n GLY 7 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1wfz h GLU 8 N 0.00 -0.53 -5.13 1.61 4.57 -2.06 -3.42 114.58 109.63 1wfz h GLU 8 Ca 0.00 0.04 -0.66 0.00 -1.18 0.00 0.00 59.36 57.55 1wfz h GLU 8 Cb 0.00 0.12 -0.16 0.00 -0.16 0.00 0.00 28.75 28.55 1wfz h GLU 8 CO 0.00 -0.35 -0.08 0.54 -1.18 0.00 0.00 179.01 177.94 1wfz s ASN 9 N -4.44 6.27 1.13 1.04 2.20 -1.26 -5.07 114.94 114.81 1wfz s ASN 9 Ca -0.08 -0.33 -0.11 0.00 -0.94 0.00 0.00 52.86 51.40 1wfz s ASN 9 Cb 0.01 -2.26 0.16 0.00 -2.00 0.00 0.00 41.25 37.16 1wfz s ASN 9 CO 0.24 -0.57 0.57 -0.81 -2.94 0.00 0.00 177.10 173.59 1wfz n PRO 10 N 5.79 -2.13 0.21 3.55 -0.04 -1.26 -4.94 135.00 136.18 1wfz n PRO 10 Ca -0.05 -0.91 0.09 0.00 -0.04 0.00 0.00 63.50 62.59 1wfz n PRO 10 Cb 0.48 -0.85 0.39 0.00 -0.04 0.00 0.00 33.50 33.48 1wfz n PRO 10 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wfz h ARG 11 N 0.00 0.00 -1.87 0.54 2.47 -1.99 -3.21 114.38 110.32 1wfz h ARG 11 Ca -0.21 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.35 1wfz h ARG 11 Cb 0.65 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.91 1wfz h ARG 11 CO 0.14 0.27 0.08 0.09 0.56 0.00 0.00 179.97 181.11 1wfz n ASN 12 N -3.39 5.72 -3.46 7.04 3.02 -1.26 -4.51 115.26 118.42 1wfz n ASN 12 Ca 0.00 -2.66 -0.26 0.00 -0.03 0.00 0.00 54.58 51.63 1wfz n ASN 12 Cb 0.48 -1.16 -0.09 0.00 -0.61 0.00 0.00 39.78 38.39 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 1.30 0.10 0.00 2.41 0.31 -1.21 -4.68 118.33 116.56 1wfz n VAL 13 Ca 0.19 -4.17 0.00 0.00 -0.01 0.00 0.00 64.34 60.34 1wfz n VAL 13 Cb 0.59 -1.92 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 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 1.96 0.52 3.19 2.92 0.00 -1.26 -5.01 105.19 107.51 1wfz n GLY 14 Ca 0.25 -1.27 0.04 0.00 0.00 0.00 0.00 46.02 45.04 1wfz n GLY 14 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wfz s SER 15 N -1.08 -1.24 0.18 1.61 0.01 -1.26 -5.04 113.70 106.89 1wfz s SER 15 Ca 0.00 0.86 0.03 0.00 1.31 0.00 0.00 55.95 58.15 1wfz s SER 15 Cb 0.00 2.07 -0.03 0.00 0.21 0.00 0.00 66.02 68.27 1wfz s SER 15 CO 0.00 -0.23 0.32 -0.76 0.41 0.00 0.00 173.24 172.98 1wfz s LEU 16 N 2.87 4.32 -0.55 2.44 1.43 -1.26 -5.04 118.68 122.88 1wfz s LEU 16 Ca 0.16 0.17 -0.28 0.00 -1.03 0.00 0.00 54.13 53.15 1wfz s LEU 16 Cb -0.14 -2.93 0.00 0.00 0.03 0.00 0.00 46.19 43.15 1wfz s LEU 16 CO -0.20 -0.00 1.57 -0.62 0.23 0.00 0.00 176.35 177.34 1wfz s ASP 17 N -3.46 5.87 0.30 2.29 2.15 -1.26 -4.85 116.67 117.71 1wfz s ASP 17 Ca 0.35 0.39 0.05 0.00 0.43 0.00 0.00 52.55 53.77 1wfz s ASP 17 Cb -0.10 -2.54 0.47 0.00 -0.30 0.00 0.00 42.92 40.44 1wfz s ASP 17 CO 0.29 -1.89 1.73 0.07 -0.17 0.00 0.00 175.17 175.20 1wfz h LYS 18 N 12.26 0.34 -0.51 4.34 2.10 -1.96 -3.02 116.57 130.13 1wfz h LYS 18 Ca -0.28 -0.14 -0.04 0.00 -2.00 0.00 0.00 60.65 58.19 1wfz h LYS 18 Cb 1.12 -0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 32.41 1wfz h LYS 18 CO 1.17 0.63 0.15 1.79 -2.00 0.00 0.00 179.45 181.19 1wfz h THR 19 N 0.30 1.23 -2.78 0.07 1.35 -1.91 -3.45 112.91 107.72 1wfz h THR 19 Ca 0.04 -0.79 -0.49 0.00 -0.55 0.00 0.00 66.41 64.62 1wfz h THR 19 Cb 0.71 0.78 0.23 0.00 -1.73 0.00 0.00 68.15 68.15 1wfz h THR 19 CO 0.05 0.29 -0.89 -0.24 -0.25 0.00 0.00 175.52 174.48 1wfz n SER 20 N -4.48 -2.33 -0.13 5.36 2.88 -1.14 -4.98 113.62 108.79 1wfz n SER 20 Ca 0.02 0.09 -0.24 0.00 -1.33 0.00 0.00 58.87 57.41 1wfz n SER 20 Cb 0.20 -1.06 -0.11 0.00 -0.75 0.00 0.00 64.21 62.49 1wfz n SER 20 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1wfz n LYS 21 N -1.75 0.62 -0.46 -1.46 2.85 -1.26 -4.36 118.16 112.34 1wfz n LYS 21 Ca 0.03 0.21 0.42 0.00 -1.05 0.00 0.00 58.31 57.92 1wfz n LYS 21 Cb 0.58 -1.51 0.75 0.00 -0.65 0.00 0.00 35.03 34.20 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 -0.48 0.00 -3.43 -5.58 -1.07 -1.91 -3.33 115.58 99.77 1wfz h ASN 22 Ca -0.64 0.00 -0.66 0.00 0.07 0.00 0.00 56.30 55.08 1wfz h ASN 22 Cb 1.76 0.00 -0.27 0.00 -2.07 0.00 0.00 38.32 37.75 1wfz h ASN 22 CO -0.25 0.00 -0.71 0.54 0.07 0.00 0.00 177.43 177.08 1wfz s VAL 23 N -4.82 3.51 0.76 6.14 0.11 -1.26 -0.89 120.40 123.94 1wfz s VAL 23 Ca -0.05 -0.45 -0.06 0.00 -2.93 0.00 0.00 61.98 58.50 1wfz s VAL 23 Cb 0.23 -2.60 0.12 0.00 -1.53 0.00 0.00 36.38 32.60 1wfz s VAL 23 CO 0.79 0.41 1.06 -0.83 -3.33 0.00 0.00 175.10 173.20 1wfz s GLY 24 N 1.45 1.75 -0.17 6.54 0.00 -1.00 -4.79 107.32 111.11 1wfz s GLY 24 Ca 0.05 -1.34 -0.04 0.00 0.00 0.00 0.00 44.72 43.40 1wfz s GLY 24 CO -0.02 -0.79 0.06 -1.59 0.00 0.00 0.00 173.10 170.75 1wfz s THR 25 N -3.32 0.22 -0.33 0.90 2.01 -1.26 -3.54 115.64 110.33 1wfz s THR 25 Ca 0.66 -0.29 -0.03 0.00 0.31 0.00 0.00 61.69 62.33 1wfz s THR 25 Cb -0.07 -0.76 0.06 0.00 0.01 0.00 0.00 72.50 71.74 1wfz s THR 25 CO 0.46 -0.19 0.06 -0.83 -0.69 0.00 0.00 174.62 173.43 1wfz s GLY 26 N 2.00 1.81 -0.21 4.40 0.00 0.36 -4.63 107.32 111.05 1wfz s GLY 26 Ca 0.01 -1.86 -0.05 0.00 0.00 0.00 0.00 44.72 42.81 1wfz s GLY 26 CO -0.08 0.76 0.00 -2.27 0.00 0.00 0.00 173.10 171.52 1wfz s LEU 27 N 1.28 3.22 -0.04 0.66 2.96 -1.26 -0.04 118.68 125.46 1wfz s LEU 27 Ca -0.02 -0.24 -0.02 0.00 -0.22 0.00 0.00 54.13 53.63 1wfz s LEU 27 Cb -0.20 -1.83 0.03 0.00 0.50 0.00 0.00 46.19 44.69 1wfz s LEU 27 CO -0.00 0.03 0.05 0.68 -1.32 0.00 0.00 176.35 175.79 1wfz s VAL 28 N 1.19 -0.09 0.39 1.68 -7.23 -0.59 -4.99 120.40 110.77 1wfz s VAL 28 Ca 0.03 0.40 0.08 0.00 -1.81 0.00 0.00 61.98 60.67 1wfz s VAL 28 Cb -0.14 -0.15 -0.07 0.00 0.56 0.00 0.00 36.38 36.57 1wfz s VAL 28 CO 0.01 0.17 0.00 -0.83 -0.31 0.00 0.00 175.10 174.15 1wfz s GLY 29 N 2.03 2.39 -0.17 2.32 0.00 -1.26 -2.56 107.32 110.08 1wfz s GLY 29 Ca 0.03 -2.22 -0.11 0.00 0.00 0.00 0.00 44.72 42.43 1wfz s GLY 29 CO -0.03 -2.05 0.19 0.00 0.00 0.00 0.00 173.10 171.21 1wfz s ALA 30 N -2.66 3.69 -0.02 3.20 0.00 -0.59 -4.87 121.76 120.50 1wfz s ALA 30 Ca 0.35 -0.60 -0.25 0.00 0.00 0.00 0.00 51.96 51.46 1wfz s ALA 30 Cb 0.07 -2.22 -0.20 0.00 0.00 0.00 0.00 23.12 20.78 1wfz s ALA 30 CO 0.18 0.21 1.23 -1.00 0.00 0.00 0.00 175.76 176.38 1wfz h PRO 31 N 6.39 -0.05 0.09 0.00 0.13 -1.96 0.08 132.00 136.67 1wfz h PRO 31 Ca -0.43 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1wfz h PRO 31 Cb 1.17 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1wfz h PRO 31 CO 0.73 0.42 -0.04 0.00 -0.23 0.00 0.00 178.00 178.88 1wfz h ALA 32 N 0.38 -0.54 -0.94 -0.56 0.00 -2.00 -3.32 119.26 112.28 1wfz h ALA 32 Ca -0.01 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 54.98 1wfz h ALA 32 Cb 0.49 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.25 1wfz h ALA 32 CO 0.01 -0.53 0.58 0.00 0.00 0.00 0.00 179.25 179.31 1wfz n GLY 34 N -1.34 0.90 3.57 0.00 0.00 -0.01 -4.91 105.19 103.41 1wfz n GLY 34 Ca 0.16 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.89 4.16 -0.33 1.61 1.01 -1.08 -4.74 116.67 114.41 1wfz s ASP 35 Ca 0.00 -0.80 -0.01 0.00 0.71 0.00 0.00 52.55 52.46 1wfz s ASP 35 Cb 0.00 -0.62 0.11 0.00 1.01 0.00 0.00 42.92 43.42 1wfz s ASP 35 CO 0.00 0.02 0.15 -0.69 0.21 0.00 0.00 175.17 174.86 1wfz s VAL 36 N -2.38 0.64 -0.34 -1.27 1.01 -0.76 -1.54 120.40 115.77 1wfz s VAL 36 Ca 0.31 -1.51 -0.09 0.00 0.00 0.00 0.00 61.98 60.70 1wfz s VAL 36 Cb -0.06 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 34.86 1wfz s VAL 36 CO 0.18 -0.78 0.15 -0.32 0.00 0.00 0.00 175.10 174.33 1wfz s MET 37 N 1.42 2.83 -0.28 2.72 1.75 -1.06 -1.49 119.30 125.20 1wfz s MET 37 Ca 0.12 -1.05 -0.09 0.00 -1.25 0.00 0.00 55.69 53.42 1wfz s MET 37 Cb -0.19 -3.56 -0.02 0.00 2.84 0.00 0.00 34.83 33.89 1wfz s MET 37 CO -0.19 -0.62 0.12 0.21 -0.65 0.00 0.00 175.02 173.89 1wfz s LYS 38 N 1.50 3.53 0.01 4.11 2.20 0.28 -1.54 119.74 129.83 1wfz s LYS 38 Ca 0.01 -0.58 0.01 0.00 -0.36 0.00 0.00 55.97 55.05 1wfz s LYS 38 Cb -0.19 -3.48 -0.04 0.00 -1.51 0.00 0.00 37.83 32.62 1wfz s LYS 38 CO 0.05 -0.30 0.05 -1.17 -0.36 0.00 0.00 175.35 173.62 1wfz s LEU 39 N 1.63 3.75 -0.15 5.43 2.96 0.95 -2.09 118.68 131.17 1wfz s LEU 39 Ca 0.06 0.06 -0.06 0.00 -0.22 0.00 0.00 54.13 53.97 1wfz s LEU 39 Cb -0.16 -2.23 0.07 0.00 0.50 0.00 0.00 46.19 44.37 1wfz s LEU 39 CO 0.06 0.26 0.31 -1.10 -1.32 0.00 0.00 176.35 174.55 1wfz s GLN 40 N -1.81 0.20 -0.04 1.98 -0.21 -1.22 -0.49 119.66 118.08 1wfz s GLN 40 Ca 0.23 0.80 0.06 0.00 0.02 0.00 0.00 55.36 56.47 1wfz s GLN 40 Cb -0.12 0.05 -0.01 0.00 1.00 0.00 0.00 33.01 33.93 1wfz s GLN 40 CO 0.14 -0.26 -0.22 0.96 -2.12 0.00 0.00 175.29 173.79 1wfz s ILE 41 N 2.33 1.79 -0.35 1.08 -5.25 -1.23 0.64 121.20 120.20 1wfz s ILE 41 Ca -0.01 -0.93 -0.15 0.00 -0.99 0.00 0.00 60.65 58.57 1wfz s ILE 41 Cb -0.12 -1.51 -0.01 0.00 2.95 0.00 0.00 42.46 43.77 1wfz s ILE 41 CO -0.10 0.50 0.36 -1.58 -1.79 0.00 0.00 174.94 172.33 1wfz s GLN 42 N -0.21 3.53 -0.03 0.37 0.74 -0.21 -2.37 119.66 121.48 1wfz s GLN 42 Ca -0.00 -0.45 -0.16 0.00 0.05 0.00 0.00 55.36 54.79 1wfz s GLN 42 Cb -0.12 -3.81 -0.05 0.00 1.10 0.00 0.00 33.01 30.13 1wfz s GLN 42 CO 0.02 -0.54 0.45 0.08 -0.55 0.00 0.00 175.29 174.75 1wfz s VAL 43 N 2.00 5.05 0.50 1.34 1.01 -0.07 -1.58 120.40 128.66 1wfz s VAL 43 Ca 0.11 0.92 -0.03 0.00 0.00 0.00 0.00 61.98 62.98 1wfz s VAL 43 Cb -0.17 -3.77 0.11 0.00 0.00 0.00 0.00 36.38 32.55 1wfz s VAL 43 CO 0.12 0.49 0.69 -0.67 0.00 0.00 0.00 175.10 175.72 1wfz n ASP 44 N 2.47 0.60 0.22 3.32 2.03 -1.00 -4.65 116.55 119.54 1wfz n ASP 44 Ca -0.11 -1.58 0.05 0.00 0.52 0.00 0.00 54.79 53.67 1wfz n ASP 44 Cb 0.52 -0.47 0.50 0.00 -0.72 0.00 0.00 41.12 40.94 1wfz n ASP 44 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1wfz h GLU 45 N 0.00 0.00 0.00 -0.67 4.11 -1.98 -1.78 114.58 114.26 1wfz h GLU 45 Ca -0.22 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.12 1wfz h GLU 45 Cb 0.75 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 1wfz h GLU 45 CO 0.21 0.19 -0.38 0.87 0.07 0.00 0.00 179.01 179.97 1wfz h LYS 46 N 0.00 0.00 0.00 1.06 1.57 -2.03 -3.47 116.57 113.70 1wfz h LYS 46 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wfz h LYS 46 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1wfz h LYS 46 CO 0.02 0.38 0.00 0.41 -0.57 0.00 0.00 179.45 179.70 1wfz n GLY 47 N 0.93 1.62 3.53 3.86 0.00 -0.67 -5.10 105.19 109.35 1wfz n GLY 47 Ca 0.02 -0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.74 2.95 -0.58 1.61 2.36 -1.26 -3.33 119.74 120.75 1wfz s LYS 48 Ca 0.00 -0.58 -0.27 0.00 -2.55 0.00 0.00 55.97 52.57 1wfz s LYS 48 Cb 0.00 -2.62 -0.02 0.00 -1.05 0.00 0.00 37.83 34.14 1wfz s LYS 48 CO 0.00 0.53 1.80 0.42 1.55 0.00 0.00 175.35 179.65 1wfz s ILE 49 N -0.46 3.42 -0.02 5.43 1.01 0.63 -2.37 121.20 128.85 1wfz s ILE 49 Ca 0.06 0.29 -0.00 0.00 0.00 0.00 0.00 60.65 61.00 1wfz s ILE 49 Cb -0.12 -3.97 -0.26 0.00 0.01 0.00 0.00 42.46 38.11 1wfz s ILE 49 CO 0.02 -0.90 0.76 -0.37 0.00 0.00 0.00 174.94 174.46 1wfz h VAL 50 N 6.81 1.03 -3.43 2.92 -1.51 -1.58 -1.37 116.25 119.12 1wfz h VAL 50 Ca -0.27 -2.73 -0.51 0.00 -1.23 0.00 0.00 66.70 61.96 1wfz h VAL 50 Cb 1.15 2.66 -0.18 0.00 -2.13 0.00 0.00 31.29 32.79 1wfz h VAL 50 CO 1.19 0.77 -0.78 -1.81 -1.23 0.00 0.00 177.57 175.71 1wfz s ASP 51 N -6.80 2.55 -0.20 4.19 1.01 -1.22 -4.74 116.67 111.45 1wfz s ASP 51 Ca -0.10 -0.83 -0.17 0.00 0.71 0.00 0.00 52.55 52.17 1wfz s ASP 51 Cb 0.07 -0.14 0.06 0.00 1.01 0.00 0.00 42.92 43.92 1wfz s ASP 51 CO 0.83 -0.04 0.53 0.00 0.21 0.00 0.00 175.17 176.70 1wfz s ALA 52 N -1.95 -1.32 0.36 5.23 0.00 -1.26 -1.04 121.76 121.78 1wfz s ALA 52 Ca 0.13 1.59 0.09 0.00 0.00 0.00 0.00 51.96 53.77 1wfz s ALA 52 Cb -0.06 -0.93 -0.06 0.00 0.00 0.00 0.00 23.12 22.06 1wfz s ALA 52 CO 0.06 -0.27 -0.03 1.03 0.00 0.00 0.00 175.76 176.56 1wfz s ARG 53 N 0.60 1.95 -0.27 0.00 0.52 0.21 -4.82 118.95 117.13 1wfz s ARG 53 Ca -0.03 -1.92 -0.07 0.00 -0.52 0.00 0.00 55.73 53.20 1wfz s ARG 53 Cb -0.05 -1.77 0.13 0.00 0.52 0.00 0.00 34.95 33.78 1wfz s ARG 53 CO -0.04 0.08 0.56 -0.59 0.02 0.00 0.00 175.30 175.34 1wfz s PHE 54 N -2.60 -1.21 -0.29 -0.53 -0.12 -1.26 -3.41 117.98 108.55 1wfz s PHE 54 Ca 0.34 1.91 -0.02 0.00 -0.05 0.00 0.00 56.93 59.11 1wfz s PHE 54 Cb 0.03 0.58 0.10 0.00 -0.63 0.00 0.00 43.02 43.10 1wfz s PHE 54 CO 0.18 -0.66 0.10 0.21 -0.05 0.00 0.00 175.22 175.00 1wfz s LYS 55 N 2.79 0.55 0.03 1.99 2.47 -0.89 -4.95 119.74 121.74 1wfz s LYS 55 Ca 0.01 -0.84 0.03 0.00 -1.56 0.00 0.00 55.97 53.60 1wfz s LYS 55 Cb -0.13 -1.75 -0.04 0.00 -1.46 0.00 0.00 37.83 34.45 1wfz s LYS 55 CO -0.17 -0.96 0.00 0.99 0.16 0.00 0.00 175.35 175.36 1wfz s THR 56 N 1.79 4.10 -0.22 3.43 2.01 -1.25 -0.56 115.64 124.94 1wfz s THR 56 Ca 0.08 -0.73 -0.03 0.00 0.31 0.00 0.00 61.69 61.33 1wfz s THR 56 Cb -0.17 -2.87 0.07 0.00 0.01 0.00 0.00 72.50 69.54 1wfz s THR 56 CO -0.27 0.29 0.05 -0.36 -0.69 0.00 0.00 174.62 173.64 1wfz s PHE 57 N -1.16 1.03 -0.10 4.92 0.08 -0.55 -4.93 117.98 117.27 1wfz s PHE 57 Ca 0.22 -0.96 0.00 0.00 0.12 0.00 0.00 56.93 56.31 1wfz s PHE 57 Cb -0.12 -1.10 0.00 0.00 -0.57 0.00 0.00 43.02 41.24 1wfz s PHE 57 CO 0.13 -0.66 0.00 0.41 -0.10 0.00 0.00 175.22 175.00 1wfz n GLY 58 N 5.05 0.24 3.24 4.36 0.00 -1.26 -1.82 105.19 114.99 1wfz n GLY 58 Ca -0.08 -1.09 -0.34 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.70 -0.16 -0.93 0.00 0.00 -2.00 -3.29 103.07 94.99 1wfz h GLY 60 Ca -0.48 0.06 0.35 0.00 0.00 0.00 0.00 47.33 47.25 1wfz h GLY 60 CO 0.33 -0.06 0.56 -1.14 0.00 0.00 0.00 176.54 176.24 1wfz n SER 61 N -4.88 0.21 -0.09 0.19 3.41 -1.26 0.24 113.62 111.44 1wfz n SER 61 Ca -0.02 1.16 -0.11 0.00 -0.26 0.00 0.00 58.87 59.64 1wfz n SER 61 Cb 0.07 -0.57 -0.04 0.00 -0.26 0.00 0.00 64.21 63.42 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 1.37 0.35 -0.74 7.33 0.00 -1.93 -0.78 119.26 124.85 1wfz h ALA 62 Ca 0.67 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.36 1wfz h ALA 62 Cb 1.98 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.64 1wfz h ALA 62 CO -0.46 0.03 0.31 0.82 0.00 0.00 0.00 179.25 179.94 1wfz h ILE 63 N 0.25 1.25 0.25 0.00 2.04 0.30 -2.19 117.51 119.41 1wfz h ILE 63 Ca 0.08 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 1wfz h ILE 63 Cb 0.32 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1wfz h ILE 63 CO 0.00 0.31 -0.12 0.00 0.00 0.00 0.00 178.15 178.35 1wfz h ALA 64 N 1.26 -0.70 -0.97 1.87 0.00 -1.16 -1.78 119.26 117.78 1wfz h ALA 64 Ca 0.25 -0.07 0.32 0.00 0.00 0.00 0.00 54.91 55.40 1wfz h ALA 64 Cb 0.19 0.13 -0.16 0.00 0.00 0.00 0.00 17.79 17.95 1wfz h ALA 64 CO -0.02 -0.68 0.37 0.77 0.00 0.00 0.00 179.25 179.69 1wfz h SER 65 N -0.49 0.14 0.22 0.00 0.02 -1.19 -1.26 113.55 110.99 1wfz h SER 65 Ca -0.03 0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 1wfz h SER 65 Cb 0.26 0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.08 1wfz h SER 65 CO 0.06 -0.27 -0.11 0.77 -1.14 0.00 0.00 176.83 176.14 1wfz h SER 66 N 0.14 -0.25 -0.91 3.07 4.64 -1.42 -1.02 113.55 117.79 1wfz h SER 66 Ca 0.70 0.01 0.30 0.00 -0.47 0.00 0.00 61.79 62.33 1wfz h SER 66 Cb 1.61 0.07 -0.17 0.00 -0.31 0.00 0.00 62.40 63.60 1wfz h SER 66 CO -0.73 -0.15 0.20 -0.24 -0.87 0.00 0.00 176.83 175.04 1wfz n SER 67 N -2.96 0.06 -0.07 4.97 2.88 -0.67 0.23 113.62 118.05 1wfz n SER 67 Ca -0.04 1.54 -0.08 0.00 -1.33 0.00 0.00 58.87 58.96 1wfz n SER 67 Cb 0.12 -0.63 0.08 0.00 -0.75 0.00 0.00 64.21 63.02 1wfz n SER 67 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1wfz h LEU 68 N 0.00 0.77 0.54 2.46 6.46 -1.23 -3.08 115.31 121.24 1wfz h LEU 68 Ca 0.64 -0.30 -0.03 0.00 -0.12 0.00 0.00 57.88 58.07 1wfz h LEU 68 Cb 1.49 -0.21 0.01 0.00 -0.73 0.00 0.00 40.66 41.21 1wfz h LEU 68 CO -0.80 1.01 -0.26 0.00 -0.62 0.00 0.00 178.44 177.77 1wfz h ALA 69 N 1.04 -0.88 -0.69 1.25 0.00 0.43 -2.01 119.26 118.41 1wfz h ALA 69 Ca 0.08 -0.16 0.20 0.00 0.00 0.00 0.00 54.91 55.03 1wfz h ALA 69 Cb 0.81 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1wfz h ALA 69 CO 0.07 -0.83 0.92 0.00 0.00 0.00 0.00 179.25 179.41 1wfz h THR 70 N -0.98 0.10 0.05 0.00 1.03 -1.03 1.51 112.91 113.60 1wfz h THR 70 Ca -0.07 0.00 -0.28 0.00 -0.01 0.00 0.00 66.41 66.04 1wfz h THR 70 Cb 0.56 0.23 -0.03 0.00 -1.07 0.00 0.00 68.15 67.85 1wfz h THR 70 CO 0.12 0.00 -1.50 -0.08 -0.01 0.00 0.00 175.52 174.05 1wfz h GLU 71 N 0.00 0.12 -0.48 0.00 4.81 -1.42 -3.29 114.58 114.31 1wfz h GLU 71 Ca 0.33 -0.20 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1wfz h GLU 71 Cb 2.16 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 31.59 1wfz h GLU 71 CO -0.00 0.90 0.01 -1.49 -0.73 0.00 0.00 179.01 177.69 1wfz h TRP 72 N 0.03 0.84 0.00 0.92 4.06 0.29 -2.50 115.95 119.58 1wfz h TRP 72 Ca -0.22 -0.11 -0.09 0.00 2.06 0.00 0.00 58.89 60.54 1wfz h TRP 72 Cb 1.96 -0.23 -0.01 0.00 -1.00 0.00 0.00 29.16 29.88 1wfz h TRP 72 CO 0.03 0.77 -0.41 -0.39 -3.56 0.00 0.00 178.44 174.88 1wfz h VAL 73 N 0.74 1.22 -3.15 1.49 -1.51 -1.53 -3.41 116.25 110.10 1wfz h VAL 73 Ca 0.15 -1.43 -0.53 0.00 -1.23 0.00 0.00 66.70 63.66 1wfz h VAL 73 Cb 0.44 1.79 0.08 0.00 -2.13 0.00 0.00 31.29 31.46 1wfz h VAL 73 CO 0.02 0.40 0.92 -0.54 -1.23 0.00 0.00 177.57 177.14 1wfz s LYS 74 N -4.01 4.12 0.00 5.19 1.02 -0.94 -2.00 119.74 123.11 1wfz s LYS 74 Ca -0.02 2.59 0.00 0.00 0.02 0.00 0.00 55.97 58.56 1wfz s LYS 74 Cb 0.14 -3.03 0.00 0.00 -0.52 0.00 0.00 37.83 34.41 1wfz s LYS 74 CO 0.72 -0.67 0.00 0.41 -0.92 0.00 0.00 175.35 174.89 1wfz n GLY 75 N 2.65 2.44 3.97 -3.33 0.00 -0.52 -4.99 105.19 105.41 1wfz n GLY 75 Ca 0.10 -0.14 -0.26 0.00 0.00 0.00 0.00 46.02 45.73 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 1.41 0.30 1.61 1.02 -0.84 -4.75 119.74 118.49 1wfz s LYS 76 Ca 0.00 -0.82 0.07 0.00 0.02 0.00 0.00 55.97 55.24 1wfz s LYS 76 Cb 0.00 -2.17 -0.03 0.00 -0.52 0.00 0.00 37.83 35.11 1wfz s LYS 76 CO 0.00 -1.72 0.30 0.95 -0.92 0.00 0.00 175.35 173.96 1wfz s THR 77 N -3.38 4.05 0.24 2.17 -4.23 -1.26 -0.27 115.64 112.96 1wfz s THR 77 Ca 0.68 -1.28 -0.08 0.00 -1.18 0.00 0.00 61.69 59.83 1wfz s THR 77 Cb -0.05 -3.35 0.26 0.00 1.34 0.00 0.00 72.50 70.69 1wfz s THR 77 CO 0.47 -0.23 1.64 -0.37 -0.54 0.00 0.00 174.62 175.59 1wfz h VAL 78 N 1.24 0.38 -0.53 2.29 -1.51 -1.92 0.73 116.25 116.93 1wfz h VAL 78 Ca -0.47 -0.04 0.07 0.00 -1.23 0.00 0.00 66.70 65.04 1wfz h VAL 78 Cb 1.25 0.26 -0.06 0.00 -2.13 0.00 0.00 31.29 30.61 1wfz h VAL 78 CO 0.58 0.02 0.19 -0.33 -1.23 0.00 0.00 177.57 176.81 1wfz h GLU 79 N 0.11 0.36 -0.42 5.19 5.08 -1.95 -1.94 114.58 121.01 1wfz h GLU 79 Ca 0.39 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.75 1wfz h GLU 79 Cb 0.67 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1wfz h GLU 79 CO -0.63 0.24 0.23 0.93 -1.00 0.00 0.00 179.01 178.78 1wfz h GLU 80 N 0.37 0.45 -0.66 2.33 4.39 -1.28 -1.87 114.58 118.31 1wfz h GLU 80 Ca 0.26 -0.03 0.08 0.00 0.34 0.00 0.00 59.36 60.01 1wfz h GLU 80 Cb 0.29 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.79 1wfz h GLU 80 CO -0.26 0.30 0.44 0.00 -1.16 0.00 0.00 179.01 178.33 1wfz h ALA 81 N 1.21 1.83 0.00 3.43 0.00 -0.59 0.12 119.26 125.26 1wfz h ALA 81 Ca 0.18 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1wfz h ALA 81 Cb 0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1wfz h ALA 81 CO -0.10 0.04 -0.11 -0.07 0.00 0.00 0.00 179.25 179.01 1wfz h LEU 82 N 0.60 0.00 -0.14 0.00 -0.00 -0.63 -1.82 115.31 113.32 1wfz h LEU 82 Ca 0.30 0.00 -0.18 0.00 -0.00 0.00 0.00 57.88 58.00 1wfz h LEU 82 Cb 0.38 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.01 1wfz h LEU 82 CO -0.09 0.11 -0.85 0.71 -0.00 0.00 0.00 178.44 178.31 1wfz h THR 83 N 0.00 1.53 -1.36 0.22 1.35 -0.87 -3.45 112.91 110.33 1wfz h THR 83 Ca -0.00 -3.00 -0.65 0.00 -0.55 0.00 0.00 66.41 62.21 1wfz h THR 83 Cb 0.21 2.65 -0.01 0.00 -1.73 0.00 0.00 68.15 69.27 1wfz h THR 83 CO 0.01 0.83 1.40 -0.38 -0.25 0.00 0.00 175.52 177.14 1wfz n ILE 84 N -3.40 0.25 -2.53 6.82 5.41 -0.68 -4.94 119.36 120.28 1wfz n ILE 84 Ca 0.00 -0.29 -0.23 0.00 1.00 0.00 0.00 62.75 63.23 1wfz n ILE 84 Cb 0.85 -1.85 0.12 0.00 -0.71 0.00 0.00 39.64 38.05 1wfz n ILE 84 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1wfz n LYS 85 N 8.15 -0.20 -0.02 0.38 5.02 -1.26 -4.88 118.16 125.35 1wfz n LYS 85 Ca 0.37 -2.56 -0.18 0.00 -2.02 0.00 0.00 58.31 53.91 1wfz n LYS 85 Cb 0.28 -0.71 -0.14 0.00 -0.02 0.00 0.00 35.03 34.45 1wfz n LYS 85 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1wfz n ASN 86 N -3.00 1.82 -0.21 4.39 0.23 -1.26 -4.23 115.26 113.01 1wfz n ASN 86 Ca 0.16 0.18 -0.08 0.00 -0.53 0.00 0.00 54.58 54.31 1wfz n ASN 86 Cb 0.57 -0.60 -0.04 0.00 -2.08 0.00 0.00 39.78 37.64 1wfz n ASN 86 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 1wfz h THR 87 N 0.05 0.09 0.03 5.53 1.35 -1.96 -0.28 112.91 117.71 1wfz h THR 87 Ca -0.43 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 65.45 1wfz h THR 87 Cb 2.02 0.09 -0.05 0.00 -1.73 0.00 0.00 68.15 68.48 1wfz h THR 87 CO 0.06 0.00 -0.49 0.44 -0.25 0.00 0.00 175.52 175.28 1wfz h ASP 88 N -0.22 -1.49 -0.30 5.36 5.19 -1.99 -1.27 116.42 121.70 1wfz h ASP 88 Ca 0.18 0.16 0.04 0.00 -0.62 0.00 0.00 57.03 56.79 1wfz h ASP 88 Cb 0.56 0.56 -0.06 0.00 0.18 0.00 0.00 39.33 40.57 1wfz h ASP 88 CO -0.69 -0.48 -0.44 0.40 -3.12 0.00 0.00 179.24 174.90 1wfz h ILE 89 N -0.63 0.00 -0.97 0.35 2.04 -1.54 0.27 117.51 117.03 1wfz h ILE 89 Ca 0.01 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.17 1wfz h ILE 89 Cb 0.66 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.59 1wfz h ILE 89 CO -0.31 0.00 0.46 0.00 0.00 0.00 0.00 178.15 178.30 1wfz h ALA 90 N -0.33 1.77 -0.34 1.87 0.00 -0.84 0.57 119.26 121.95 1wfz h ALA 90 Ca 0.05 0.21 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 1wfz h ALA 90 Cb 0.48 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1wfz h ALA 90 CO -0.46 -0.57 -0.43 -0.22 0.00 0.00 0.00 179.25 177.57 1wfz h LYS 91 N 0.26 0.87 -0.47 0.00 3.64 0.32 0.17 116.57 121.37 1wfz h LYS 91 Ca 0.69 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1wfz h LYS 91 Cb 1.55 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.38 1wfz h LYS 91 CO -0.64 1.13 0.30 1.49 -2.27 0.00 0.00 179.45 179.45 1wfz h GLU 92 N 0.70 0.62 0.00 1.90 4.57 0.34 -2.45 114.58 120.27 1wfz h GLU 92 Ca 0.05 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.14 1wfz h GLU 92 Cb 1.02 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.47 1wfz h GLU 92 CO 0.10 0.43 -0.29 -0.07 -1.18 0.00 0.00 179.01 178.00 1wfz h LEU 93 N 0.63 0.00 -2.08 1.64 -0.00 -1.11 -3.48 115.31 110.91 1wfz h LEU 93 Ca 0.17 0.00 -0.22 0.00 -0.00 0.00 0.00 57.88 57.83 1wfz h LEU 93 Cb -0.05 0.00 0.13 0.00 -0.00 0.00 0.00 40.66 40.75 1wfz h LEU 93 CO -0.03 0.19 -0.60 0.00 -0.00 0.00 0.00 178.44 178.00 1wfz s LEU 95 N -5.04 4.16 1.01 0.00 0.05 -0.98 -5.05 118.68 112.83 1wfz s LEU 95 Ca 0.14 0.58 -0.12 0.00 0.05 0.00 0.00 54.13 54.77 1wfz s LEU 95 Cb -0.02 -3.36 0.19 0.00 -2.05 0.00 0.00 46.19 40.96 1wfz s LEU 95 CO 0.54 -0.10 1.09 -2.16 -0.55 0.00 0.00 176.35 175.18 1wfz s PRO 96 N -3.31 0.36 0.12 1.48 0.04 -1.26 -4.92 135.00 127.51 1wfz s PRO 96 Ca 0.41 0.50 0.19 0.00 0.04 0.00 0.00 61.00 62.14 1wfz s PRO 96 Cb -0.11 -1.73 0.78 0.00 0.04 0.00 0.00 34.50 33.48 1wfz s PRO 96 CO 0.28 -2.77 1.57 -0.35 0.04 0.00 0.00 177.00 175.78 1wfz n PRO 97 N -4.20 0.09 0.02 0.56 -0.04 -1.26 -2.48 135.00 127.69 1wfz n PRO 97 Ca 0.05 0.34 -0.09 0.00 -0.04 0.00 0.00 63.50 63.76 1wfz n PRO 97 Cb 0.57 -1.68 -0.13 0.00 -0.04 0.00 0.00 33.50 32.23 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 1.29 -0.44 0.52 3.04 -2.05 -3.29 116.25 115.32 1wfz h VAL 98 Ca 0.00 -3.05 -0.01 0.00 -1.01 0.00 0.00 66.70 62.63 1wfz h VAL 98 Cb 0.30 2.65 -0.00 0.00 -2.01 0.00 0.00 31.29 32.22 1wfz h VAL 98 CO 0.00 0.75 0.01 0.29 -1.01 0.00 0.00 177.57 177.61 1wfz n LYS 99 N -3.23 3.90 -0.27 4.17 4.76 -1.04 -4.43 118.16 122.03 1wfz n LYS 99 Ca -0.09 -2.37 -0.01 0.00 -2.87 0.00 0.00 58.31 52.98 1wfz n LYS 99 Cb 1.00 -2.08 0.12 0.00 -1.84 0.00 0.00 35.03 32.23 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 2.96 0.71 -1.17 -0.35 3.38 -1.63 -2.00 115.31 117.22 1wfz h LEU 100 Ca 0.01 0.02 0.45 0.00 0.09 0.00 0.00 57.88 58.45 1wfz h LEU 100 Cb 1.63 -0.13 -0.16 0.00 0.09 0.00 0.00 40.66 42.10 1wfz h LEU 100 CO 0.38 0.46 0.69 0.00 0.09 0.00 0.00 178.44 180.06 1wfz n HIS 101 N -4.69 0.97 0.26 1.13 1.44 -1.26 -0.14 115.22 112.93 1wfz n HIS 101 Ca 0.10 0.98 -0.14 0.00 -2.01 0.00 0.00 57.72 56.65 1wfz n HIS 101 Cb 0.16 -1.39 -0.07 0.00 0.12 0.00 0.00 29.99 28.81 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 -1.01 0.03 -0.03 0.00 4.64 -0.61 0.29 113.55 116.86 1wfz h SER 103 Ca -0.07 0.22 -0.20 0.00 -0.47 0.00 0.00 61.79 61.28 1wfz h SER 103 Cb 0.61 0.29 0.01 0.00 -0.31 0.00 0.00 62.40 63.01 1wfz h SER 103 CO 0.12 -0.24 -0.75 0.00 -0.87 0.00 0.00 176.83 175.09 1wfz h MET 104 N 0.15 0.56 -0.87 4.77 -0.00 -1.38 -3.26 114.93 114.91 1wfz h MET 104 Ca 0.64 -0.56 0.20 0.00 -0.00 0.00 0.00 59.70 59.97 1wfz h MET 104 Cb 1.40 0.15 -0.12 0.00 -0.00 0.00 0.00 31.60 33.03 1wfz h MET 104 CO -0.72 1.19 0.37 1.25 -0.00 0.00 0.00 176.91 178.99 1wfz h LEU 105 N 0.16 0.31 -0.61 -0.10 5.85 0.20 0.12 115.31 121.25 1wfz h LEU 105 Ca -0.08 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1wfz h LEU 105 Cb 1.42 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.55 1wfz h LEU 105 CO 0.15 0.02 0.36 0.00 -0.34 0.00 0.00 178.44 178.63 1wfz h ALA 106 N 1.68 0.77 0.14 1.25 0.00 -1.30 -1.56 119.26 120.24 1wfz h ALA 106 Ca 0.53 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1wfz h ALA 106 Cb 0.96 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1wfz h ALA 106 CO -0.51 0.26 -0.07 1.49 0.00 0.00 0.00 179.25 180.43 1wfz h GLU 107 N 0.82 -0.18 -0.69 0.00 4.81 -0.87 -2.25 114.58 116.22 1wfz h GLU 107 Ca 0.22 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.54 1wfz h GLU 107 Cb -0.00 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.35 1wfz h GLU 107 CO -0.04 -0.05 0.34 -0.44 -0.73 0.00 0.00 179.01 178.09 1wfz h ASP 108 N -0.27 0.46 -0.24 1.04 3.32 -1.06 -2.10 116.42 117.57 1wfz h ASP 108 Ca -0.02 0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.12 1wfz h ASP 108 Cb 0.21 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.70 1wfz h ASP 108 CO 0.03 0.27 0.02 0.00 -1.72 0.00 0.00 179.24 177.84 1wfz h ALA 109 N 1.40 0.22 0.45 3.45 0.00 -1.09 -1.06 119.26 122.63 1wfz h ALA 109 Ca 0.33 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 1wfz h ALA 109 Cb 0.32 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1wfz h ALA 109 CO -0.25 -0.41 -0.45 0.82 0.00 0.00 0.00 179.25 178.97 1wfz h ILE 110 N 0.10 0.00 -0.38 0.00 2.04 -0.79 -1.95 117.51 116.53 1wfz h ILE 110 Ca 0.11 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.05 1wfz h ILE 110 Cb 0.13 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.12 1wfz h ILE 110 CO -0.18 0.00 -0.34 0.11 0.00 0.00 0.00 178.15 177.75 1wfz h LYS 111 N -0.89 -0.26 -0.87 2.37 6.56 -1.32 -0.17 116.57 121.99 1wfz h LYS 111 Ca -0.06 0.02 0.22 0.00 -1.06 0.00 0.00 60.65 59.78 1wfz h LYS 111 Cb 0.78 0.06 -0.13 0.00 -0.57 0.00 0.00 32.23 32.36 1wfz h LYS 111 CO -0.06 -0.18 0.26 0.00 -2.06 0.00 0.00 179.45 177.42 1wfz h ALA 112 N 0.69 1.27 -0.13 3.86 0.00 -1.03 -0.92 119.26 123.01 1wfz h ALA 112 Ca 0.16 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1wfz h ALA 112 Cb 0.55 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1wfz h ALA 112 CO -0.53 -0.43 0.00 0.00 0.00 0.00 0.00 179.25 178.29 1wfz n ALA 113 N -2.66 -0.34 -0.15 0.00 0.00 -0.09 -1.47 120.51 115.80 1wfz n ALA 113 Ca 0.21 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.54 1wfz n ALA 113 Cb 0.66 0.15 -0.06 0.00 0.00 0.00 0.00 19.45 20.19 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 -1.57 -0.07 0.00 -0.00 -1.23 -2.17 115.31 110.28 1wfz h LEU 114 Ca 0.00 0.23 0.01 0.00 -0.00 0.00 0.00 57.88 58.12 1wfz h LEU 114 Cb 0.00 0.68 -0.01 0.00 -0.00 0.00 0.00 40.66 41.33 1wfz h LEU 114 CO 0.00 -0.37 -0.05 0.00 -0.00 0.00 0.00 178.44 178.02 1wfz h ALA 115 N 0.36 -0.12 -0.98 1.53 0.00 -1.14 0.94 119.26 119.84 1wfz h ALA 115 Ca 0.13 0.01 0.24 0.00 0.00 0.00 0.00 54.91 55.28 1wfz h ALA 115 Cb 0.58 0.96 -0.18 0.00 0.00 0.00 0.00 17.79 19.15 1wfz h ALA 115 CO -0.61 -0.15 -0.10 0.22 0.00 0.00 0.00 179.25 178.61 1wfz h ASP 116 N -0.01 -0.68 -0.55 0.00 1.82 -0.90 0.73 116.42 116.83 1wfz h ASP 116 Ca 0.01 0.29 0.04 0.00 -0.39 0.00 0.00 57.03 56.98 1wfz h ASP 116 Cb 0.04 0.54 -0.04 0.00 0.68 0.00 0.00 39.33 40.54 1wfz h ASP 116 CO -0.07 -0.34 0.29 0.22 -1.61 0.00 0.00 179.24 177.74 1wfz h TYR 117 N 0.01 0.54 -0.27 0.28 3.20 -0.28 -2.55 116.97 117.89 1wfz h TYR 117 Ca 0.54 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.42 1wfz h TYR 117 Cb 0.99 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.08 1wfz h TYR 117 CO -0.62 0.27 0.13 0.87 -1.64 0.00 0.00 178.16 177.18 1wfz h LYS 118 N 0.57 0.39 -0.82 1.82 1.57 0.25 -2.87 116.57 117.47 1wfz h LYS 118 Ca 0.24 -0.05 0.20 0.00 -1.87 0.00 0.00 60.65 59.16 1wfz h LYS 118 Cb 0.12 -0.07 -0.14 0.00 0.08 0.00 0.00 32.23 32.21 1wfz h LYS 118 CO -0.15 0.37 0.02 -0.07 -0.57 0.00 0.00 179.45 179.05 1wfz h LEU 119 N 0.31 -0.37 -1.36 2.94 3.38 -0.59 0.77 115.31 120.38 1wfz h LEU 119 Ca 0.09 0.22 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 1wfz h LEU 119 Cb 0.11 0.38 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1wfz h LEU 119 CO -0.01 -0.22 0.18 0.11 0.09 0.00 0.00 178.44 178.59 1wfz h LYS 120 N 0.09 0.61 -0.09 1.13 1.57 -1.33 -2.09 116.57 116.47 1wfz h LYS 120 Ca 0.46 -0.08 -0.14 0.00 -1.87 0.00 0.00 60.65 59.03 1wfz h LYS 120 Cb 0.85 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 1wfz h LYS 120 CO -0.73 0.50 -0.56 1.96 -0.57 0.00 0.00 179.45 180.06 1wfz h GLN 121 N 0.61 0.27 0.64 3.15 1.08 0.58 -3.16 115.11 118.28 1wfz h GLN 121 Ca 0.15 -0.17 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 1wfz h GLN 121 Cb 0.12 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.55 1wfz h GLN 121 CO -0.02 0.75 -0.48 0.93 -0.95 0.00 0.00 178.83 179.06 1wfz h GLU 122 N 0.21 -1.04 0.00 1.46 4.39 -0.20 -3.45 114.58 115.94 1wfz h GLU 122 Ca 0.00 0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1wfz h GLU 122 Cb 1.04 0.24 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 1wfz h GLU 122 CO 0.09 -0.70 0.00 0.45 -1.16 0.00 0.00 179.01 177.69 1wfz n SER 123 N -5.45 0.00 -3.55 1.42 2.88 -1.17 -5.12 113.62 102.62 1wfz n SER 123 Ca -0.13 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.34 1wfz n SER 123 Cb 0.47 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.91 1wfz n SER 123 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1wfz s LYS 124 N -0.53 0.58 -0.95 -1.46 2.20 -1.19 -5.00 119.74 113.39 1wfz s LYS 124 Ca 0.00 -0.21 -0.17 0.00 -0.36 0.00 0.00 55.97 55.23 1wfz s LYS 124 Cb 0.00 0.27 -0.28 0.00 -1.51 0.00 0.00 37.83 36.31 1wfz s LYS 124 CO 0.00 -0.25 2.32 -1.13 -0.36 0.00 0.00 175.35 175.93 1wfz n SER 125 N -0.16 -0.52 -4.80 1.43 3.41 -1.26 -4.67 113.62 107.04 1wfz n SER 125 Ca -0.05 -0.49 -0.34 0.00 -0.26 0.00 0.00 58.87 57.74 1wfz n SER 125 Cb 0.60 -0.80 -0.04 0.00 -0.26 0.00 0.00 64.21 63.72 1wfz n SER 125 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1wfz s GLY 126 N 3.89 2.52 -0.35 5.00 0.00 -1.26 -4.97 107.32 112.16 1wfz s GLY 126 Ca 1.27 0.60 -0.28 0.00 0.00 0.00 0.00 44.72 46.31 1wfz s GLY 126 CO 0.48 0.93 1.70 2.56 0.00 0.00 0.00 173.10 178.77 1wfz s PRO 127 N -3.15 3.40 0.22 2.90 0.04 -1.26 -4.96 135.00 132.19 1wfz s PRO 127 Ca 0.66 1.31 -0.13 0.00 0.04 0.00 0.00 61.00 62.87 1wfz s PRO 127 Cb -0.16 -4.15 0.00 0.00 0.04 0.00 0.00 34.50 30.23 1wfz s PRO 127 CO 0.20 -1.78 0.45 -1.12 0.04 0.00 0.00 177.00 174.79 1wfz s SER 128 N 5.52 -0.10 -0.09 6.66 0.01 -1.26 -5.14 113.70 119.29 1wfz s SER 128 Ca 0.75 -0.81 -0.26 0.00 1.31 0.00 0.00 55.95 56.94 1wfz s SER 128 Cb -0.20 0.55 -0.02 0.00 0.21 0.00 0.00 66.02 66.55 1wfz s SER 128 CO 0.33 -1.06 0.84 -0.94 0.41 0.00 0.00 173.24 172.82 1wfz s SER 129 N -2.97 7.08 0.00 2.44 1.04 -1.26 -5.29 113.70 114.74 1wfz s SER 129 Ca 0.18 1.31 0.27 0.00 0.48 0.00 0.00 55.95 58.19 1wfz s SER 129 Cb 0.00 -2.47 0.80 0.00 0.10 0.00 0.00 66.02 64.45 1wfz s SER 129 CO 0.04 -0.28 1.60 0.61 0.98 0.00 0.00 173.24 176.19