#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wfz n SER 2 N 0.00 0.19 -3.65 1.61 7.64 -1.26 -5.16 113.62 112.99 1wfz n SER 2 Ca 0.00 0.38 -0.04 0.00 1.01 0.00 0.00 58.87 60.22 1wfz n SER 2 Cb 0.00 0.19 -0.01 0.00 -1.01 0.00 0.00 64.21 63.38 1wfz n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1wfz s SER 3 N -5.25 -0.21 -0.23 6.43 1.04 -1.26 -5.10 113.70 109.13 1wfz s SER 3 Ca 0.00 -0.21 -0.05 0.00 0.48 0.00 0.00 55.95 56.17 1wfz s SER 3 Cb 0.00 0.38 0.02 0.00 0.10 0.00 0.00 66.02 66.52 1wfz s SER 3 CO 0.00 -0.67 0.11 0.61 0.98 0.00 0.00 173.24 174.27 1wfz n GLY 4 N -0.38 -4.29 1.24 7.32 0.00 -1.26 -5.02 105.19 102.80 1wfz n GLY 4 Ca -0.07 1.01 0.00 0.00 0.00 0.00 0.00 46.02 46.96 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 1.27 0.08 -0.12 1.61 7.64 -1.26 -4.92 113.62 117.91 1wfz n SER 5 Ca -0.18 0.02 -0.25 0.00 1.01 0.00 0.00 58.87 59.46 1wfz n SER 5 Cb 0.31 -0.02 -0.11 0.00 -1.01 0.00 0.00 64.21 63.39 1wfz n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wfz n SER 6 N -2.94 1.95 -0.95 6.43 2.88 -1.26 -5.11 113.62 114.62 1wfz n SER 6 Ca 0.00 0.27 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 1wfz n SER 6 Cb 0.34 -0.79 0.00 0.00 -0.75 0.00 0.00 64.21 63.02 1wfz n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wfz n GLY 7 N 1.52 -3.39 3.40 0.46 0.00 -1.26 -5.00 105.19 100.92 1wfz n GLY 7 Ca -0.47 -0.59 -0.38 0.00 0.00 0.00 0.00 46.02 44.58 1wfz n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wfz s GLU 8 N -2.21 3.17 -0.14 1.61 2.12 -1.26 -5.07 118.70 116.92 1wfz s GLU 8 Ca 0.00 -0.83 0.02 0.00 0.36 0.00 0.00 54.97 54.52 1wfz s GLU 8 Cb 0.00 -3.54 0.01 0.00 0.26 0.00 0.00 34.13 30.87 1wfz s GLU 8 CO 0.00 -0.48 -0.19 0.54 -0.54 0.00 0.00 175.26 174.60 1wfz s ASN 9 N 1.57 2.87 1.13 -1.70 4.22 -1.26 -5.13 114.94 116.63 1wfz s ASN 9 Ca 0.03 -0.55 -0.17 0.00 -2.14 0.00 0.00 52.86 50.04 1wfz s ASN 9 Cb -0.17 -1.31 0.25 0.00 1.28 0.00 0.00 41.25 41.29 1wfz s ASN 9 CO 0.05 0.03 1.10 -2.16 -2.04 0.00 0.00 177.10 174.08 1wfz s PRO 10 N 1.05 -0.64 0.01 3.55 0.04 -1.26 -5.05 135.00 132.69 1wfz s PRO 10 Ca -0.03 0.14 -0.04 0.00 0.04 0.00 0.00 61.00 61.12 1wfz s PRO 10 Cb -0.14 -1.65 -0.02 0.00 0.04 0.00 0.00 34.50 32.73 1wfz s PRO 10 CO -0.05 -3.37 -0.08 0.54 0.04 0.00 0.00 177.00 174.08 1wfz n ARG 11 N -4.56 0.12 -0.22 4.56 3.00 -1.26 -4.70 116.66 113.59 1wfz n ARG 11 Ca 0.10 0.05 0.16 0.00 -0.01 0.00 0.00 57.85 58.15 1wfz n ARG 11 Cb 0.59 -0.70 0.31 0.00 0.00 0.00 0.00 32.46 32.65 1wfz n ARG 11 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1wfz n ASN 12 N -3.56 0.09 -3.39 0.55 2.85 -1.26 -4.52 115.26 106.03 1wfz n ASN 12 Ca -0.06 1.13 -0.42 0.00 -0.11 0.00 0.00 54.58 55.12 1wfz n ASN 12 Cb 0.27 -0.49 -0.05 0.00 1.24 0.00 0.00 39.78 40.76 1wfz n ASN 12 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1wfz n VAL 13 N -4.70 0.50 -0.61 3.44 0.31 -1.26 -4.73 118.33 111.28 1wfz n VAL 13 Ca 0.21 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 1wfz n VAL 13 Cb 0.71 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.64 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 1.26 3.91 3.26 2.92 0.00 -1.26 -4.94 105.19 110.35 1wfz n GLY 14 Ca 0.15 -0.44 0.03 0.00 0.00 0.00 0.00 46.02 45.76 1wfz n GLY 14 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wfz s SER 15 N 1.82 -0.29 0.38 1.61 1.04 -1.26 -4.69 113.70 112.31 1wfz s SER 15 Ca 0.00 0.37 0.07 0.00 0.48 0.00 0.00 55.95 56.87 1wfz s SER 15 Cb 0.00 1.32 -0.00 0.00 0.10 0.00 0.00 66.02 67.44 1wfz s SER 15 CO 0.00 -0.06 0.50 -0.76 0.98 0.00 0.00 173.24 173.90 1wfz s LEU 16 N 2.31 3.77 0.39 2.42 1.43 -1.26 -5.06 118.68 122.67 1wfz s LEU 16 Ca -0.01 -0.35 -0.27 0.00 -1.03 0.00 0.00 54.13 52.47 1wfz s LEU 16 Cb -0.04 -2.63 -0.11 0.00 0.03 0.00 0.00 46.19 43.45 1wfz s LEU 16 CO -0.16 -0.60 1.36 -0.67 0.23 0.00 0.00 176.35 176.52 1wfz n ASP 17 N -1.72 3.09 -0.07 2.29 2.03 -1.26 -4.93 116.55 115.98 1wfz n ASP 17 Ca 0.04 1.17 -0.11 0.00 0.52 0.00 0.00 54.79 56.41 1wfz n ASP 17 Cb 0.59 -1.55 -0.15 0.00 -0.72 0.00 0.00 41.12 39.29 1wfz n ASP 17 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1wfz n LYS 18 N 0.26 0.67 -0.07 -0.67 0.00 -1.26 -4.37 118.16 112.72 1wfz n LYS 18 Ca 0.04 0.12 -0.15 0.00 -0.00 0.00 0.00 58.31 58.32 1wfz n LYS 18 Cb 0.39 -1.62 -0.05 0.00 -0.00 0.00 0.00 35.03 33.75 1wfz n LYS 18 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.40 179.19 1wfz h THR 19 N 0.01 1.29 -0.84 0.58 1.35 -1.92 -3.44 112.91 109.94 1wfz h THR 19 Ca -0.47 -1.74 -0.64 0.00 -0.55 0.00 0.00 66.41 63.02 1wfz h THR 19 Cb 2.12 1.74 -0.03 0.00 -1.73 0.00 0.00 68.15 70.25 1wfz h THR 19 CO 0.03 0.56 1.47 -1.20 -0.25 0.00 0.00 175.52 176.13 1wfz n SER 20 N -4.06 1.71 0.06 5.36 7.64 -1.26 -4.77 113.62 118.30 1wfz n SER 20 Ca -0.05 0.32 0.19 0.00 1.01 0.00 0.00 58.87 60.33 1wfz n SER 20 Cb 0.62 -1.20 0.71 0.00 -1.01 0.00 0.00 64.21 63.33 1wfz n SER 20 CO 0.00 0.00 0.00 0.07 -3.01 0.00 0.00 175.04 172.10 1wfz h LYS 21 N 12.63 0.00 -0.36 1.43 -0.00 -1.94 0.53 116.57 128.87 1wfz h LYS 21 Ca -0.21 0.00 -0.04 0.00 -0.00 0.00 0.00 60.65 60.40 1wfz h LYS 21 Cb 1.33 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.54 1wfz h LYS 21 CO 1.09 0.00 0.05 -2.95 -0.00 0.00 0.00 179.45 177.64 1wfz h ASN 22 N 0.00 0.50 -3.51 7.07 -1.07 -1.86 -3.41 115.58 113.31 1wfz h ASN 22 Ca 0.20 -0.08 -0.65 0.00 0.07 0.00 0.00 56.30 55.84 1wfz h ASN 22 Cb 0.84 -0.13 -0.23 0.00 -2.07 0.00 0.00 38.32 36.73 1wfz h ASN 22 CO -0.00 0.54 -0.65 0.54 0.07 0.00 0.00 177.43 177.92 1wfz s VAL 23 N -5.06 4.07 0.63 6.14 0.11 0.18 -0.90 120.40 125.55 1wfz s VAL 23 Ca -0.08 -0.26 -0.05 0.00 -2.93 0.00 0.00 61.98 58.65 1wfz s VAL 23 Cb 0.16 -2.87 0.03 0.00 -1.53 0.00 0.00 36.38 32.17 1wfz s VAL 23 CO 0.76 0.39 0.93 -0.83 -3.33 0.00 0.00 175.10 173.02 1wfz s GLY 24 N 1.29 1.65 -0.25 6.54 0.00 -0.77 -4.62 107.32 111.16 1wfz s GLY 24 Ca 0.04 -0.83 -0.01 0.00 0.00 0.00 0.00 44.72 43.92 1wfz s GLY 24 CO 0.02 -0.51 0.04 -1.59 0.00 0.00 0.00 173.10 171.06 1wfz s THR 25 N -3.06 0.91 -0.34 0.90 2.01 -1.26 -3.26 115.64 111.54 1wfz s THR 25 Ca 0.56 -1.05 -0.06 0.00 0.31 0.00 0.00 61.69 61.45 1wfz s THR 25 Cb -0.11 -1.47 0.05 0.00 0.01 0.00 0.00 72.50 70.98 1wfz s THR 25 CO 0.44 -0.37 0.11 -0.83 -0.69 0.00 0.00 174.62 173.28 1wfz s GLY 26 N 1.65 1.85 -0.15 4.40 0.00 -0.24 -4.63 107.32 110.20 1wfz s GLY 26 Ca 0.02 -1.85 -0.02 0.00 0.00 0.00 0.00 44.72 42.87 1wfz s GLY 26 CO -0.14 0.80 -0.08 -2.27 0.00 0.00 0.00 173.10 171.41 1wfz s LEU 27 N 1.36 2.95 -0.16 0.66 2.96 -1.26 0.11 118.68 125.30 1wfz s LEU 27 Ca -0.01 -0.26 -0.05 0.00 -0.22 0.00 0.00 54.13 53.59 1wfz s LEU 27 Cb -0.20 -1.70 0.08 0.00 0.50 0.00 0.00 46.19 44.87 1wfz s LEU 27 CO 0.02 0.14 0.30 0.68 -1.32 0.00 0.00 176.35 176.16 1wfz s VAL 28 N 0.53 -0.46 0.48 1.68 -7.23 -0.49 -4.95 120.40 109.95 1wfz s VAL 28 Ca -0.06 0.19 0.05 0.00 -1.81 0.00 0.00 61.98 60.34 1wfz s VAL 28 Cb -0.15 -0.54 -0.02 0.00 0.56 0.00 0.00 36.38 36.23 1wfz s VAL 28 CO 0.03 0.05 0.15 -0.83 -0.31 0.00 0.00 175.10 174.19 1wfz s GLY 29 N 2.46 2.60 -0.17 2.32 0.00 -1.26 -2.43 107.32 110.85 1wfz s GLY 29 Ca 0.02 -1.35 -0.07 0.00 0.00 0.00 0.00 44.72 43.32 1wfz s GLY 29 CO -0.10 -2.04 0.07 0.00 0.00 0.00 0.00 173.10 171.02 1wfz s ALA 30 N -2.75 3.45 -0.02 3.20 0.00 -0.64 -4.87 121.76 120.13 1wfz s ALA 30 Ca 0.27 -0.74 -0.26 0.00 0.00 0.00 0.00 51.96 51.23 1wfz s ALA 30 Cb 0.03 -1.90 -0.20 0.00 0.00 0.00 0.00 23.12 21.04 1wfz s ALA 30 CO 0.15 0.25 1.26 -1.00 0.00 0.00 0.00 175.76 176.42 1wfz h PRO 31 N 6.43 0.01 0.09 0.00 0.13 -1.96 0.79 132.00 137.49 1wfz h PRO 31 Ca -0.40 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1wfz h PRO 31 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1wfz h PRO 31 CO 0.69 0.50 -0.04 0.00 -0.23 0.00 0.00 178.00 178.91 1wfz h ALA 32 N 0.51 -0.62 -1.01 -0.56 0.00 -2.00 -3.31 119.26 112.28 1wfz h ALA 32 Ca 0.00 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1wfz h ALA 32 Cb 0.50 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 1wfz h ALA 32 CO 0.00 -0.61 0.65 0.00 0.00 0.00 0.00 179.25 179.29 1wfz n GLY 34 N -1.36 0.89 3.60 0.00 0.00 0.24 -4.91 105.19 103.65 1wfz n GLY 34 Ca 0.16 -0.35 -0.24 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.84 4.16 -0.33 1.61 1.01 -1.02 -4.71 116.67 114.53 1wfz s ASP 35 Ca 0.00 -0.92 -0.01 0.00 0.71 0.00 0.00 52.55 52.33 1wfz s ASP 35 Cb 0.00 -0.56 0.11 0.00 1.01 0.00 0.00 42.92 43.48 1wfz s ASP 35 CO 0.00 -0.13 0.15 -0.69 0.21 0.00 0.00 175.17 174.71 1wfz s VAL 36 N -2.47 0.60 -0.52 -1.27 1.01 -0.71 -1.62 120.40 115.43 1wfz s VAL 36 Ca 0.33 -1.48 -0.16 0.00 0.00 0.00 0.00 61.98 60.66 1wfz s VAL 36 Cb -0.02 -1.46 0.10 0.00 0.00 0.00 0.00 36.38 35.00 1wfz s VAL 36 CO 0.19 -0.78 0.50 -0.32 0.00 0.00 0.00 175.10 174.68 1wfz s MET 37 N 1.44 3.00 -0.43 2.72 1.75 -1.02 -1.60 119.30 125.17 1wfz s MET 37 Ca 0.12 -1.45 -0.16 0.00 -1.25 0.00 0.00 55.69 52.95 1wfz s MET 37 Cb -0.19 -4.21 0.03 0.00 2.84 0.00 0.00 34.83 33.30 1wfz s MET 37 CO -0.19 -1.23 0.39 0.21 -0.65 0.00 0.00 175.02 173.55 1wfz s LYS 38 N 1.84 3.03 0.04 4.11 2.20 0.51 -1.40 119.74 130.07 1wfz s LYS 38 Ca 0.06 -0.95 -0.01 0.00 -0.36 0.00 0.00 55.97 54.71 1wfz s LYS 38 Cb -0.26 -4.00 -0.04 0.00 -1.51 0.00 0.00 37.83 32.01 1wfz s LYS 38 CO 0.06 -0.86 0.19 -1.17 -0.36 0.00 0.00 175.35 173.20 1wfz s LEU 39 N 1.92 4.31 -0.20 5.43 2.96 0.12 -2.21 118.68 131.01 1wfz s LEU 39 Ca 0.08 0.27 -0.08 0.00 -0.22 0.00 0.00 54.13 54.19 1wfz s LEU 39 Cb -0.19 -2.81 0.09 0.00 0.50 0.00 0.00 46.19 43.78 1wfz s LEU 39 CO 0.11 0.20 0.43 -1.10 -1.32 0.00 0.00 176.35 174.67 1wfz s GLN 40 N -2.31 0.35 -0.05 1.98 -0.21 -1.16 -1.08 119.66 117.18 1wfz s GLN 40 Ca 0.32 1.01 0.04 0.00 0.02 0.00 0.00 55.36 56.75 1wfz s GLN 40 Cb -0.13 0.28 0.00 0.00 1.00 0.00 0.00 33.01 34.17 1wfz s GLN 40 CO 0.24 -0.23 -0.16 0.96 -2.12 0.00 0.00 175.29 173.98 1wfz s ILE 41 N 2.39 1.41 -0.43 1.08 -5.25 -1.20 -1.16 121.20 118.03 1wfz s ILE 41 Ca -0.03 -0.68 -0.18 0.00 -0.99 0.00 0.00 60.65 58.76 1wfz s ILE 41 Cb -0.11 -1.23 0.03 0.00 2.95 0.00 0.00 42.46 44.10 1wfz s ILE 41 CO -0.13 0.41 0.49 -1.58 -1.79 0.00 0.00 174.94 172.34 1wfz s GLN 42 N 0.22 3.12 0.05 0.37 0.74 0.83 -1.85 119.66 123.13 1wfz s GLN 42 Ca -0.08 -0.73 -0.22 0.00 0.05 0.00 0.00 55.36 54.39 1wfz s GLN 42 Cb -0.13 -3.98 -0.06 0.00 1.10 0.00 0.00 33.01 29.94 1wfz s GLN 42 CO 0.03 -0.92 0.65 0.08 -0.55 0.00 0.00 175.29 174.58 1wfz s VAL 43 N 2.28 4.76 0.49 1.34 1.01 -0.08 -2.07 120.40 128.13 1wfz s VAL 43 Ca 0.14 1.38 -0.02 0.00 0.00 0.00 0.00 61.98 63.47 1wfz s VAL 43 Cb -0.17 -3.99 0.10 0.00 0.00 0.00 0.00 36.38 32.32 1wfz s VAL 43 CO 0.14 0.45 0.67 -0.67 0.00 0.00 0.00 175.10 175.70 1wfz n ASP 44 N 2.35 0.71 -0.12 3.32 2.03 -1.11 -4.62 116.55 119.11 1wfz n ASP 44 Ca -0.07 -1.64 0.00 0.00 0.52 0.00 0.00 54.79 53.60 1wfz n ASP 44 Cb 0.50 -0.46 0.27 0.00 -0.72 0.00 0.00 41.12 40.72 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 0.78 0.00 -0.67 4.11 -1.98 -1.47 114.58 115.35 1wfz h GLU 45 Ca -0.22 -0.09 -0.05 0.00 0.07 0.00 0.00 59.36 59.07 1wfz h GLU 45 Cb 0.77 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1wfz h GLU 45 CO 0.22 0.61 -0.23 0.87 0.07 0.00 0.00 179.01 180.55 1wfz h LYS 46 N 0.78 0.00 0.00 1.06 1.57 -2.03 -3.46 116.57 114.49 1wfz h LYS 46 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1wfz h LYS 46 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1wfz h LYS 46 CO -0.03 0.23 0.00 0.41 -0.57 0.00 0.00 179.45 179.49 1wfz n GLY 47 N 0.14 1.46 3.45 3.86 0.00 -0.55 -5.08 105.19 108.45 1wfz n GLY 47 Ca 0.00 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.12 3.12 -0.39 1.61 2.36 -1.26 -3.08 119.74 120.98 1wfz s LYS 48 Ca 0.00 -0.64 -0.28 0.00 -2.55 0.00 0.00 55.97 52.50 1wfz s LYS 48 Cb 0.00 -2.60 -0.03 0.00 -1.05 0.00 0.00 37.83 34.15 1wfz s LYS 48 CO 0.00 0.38 1.97 0.42 1.55 0.00 0.00 175.35 179.68 1wfz s ILE 49 N -0.08 3.30 -0.11 5.43 1.01 -0.62 -2.76 121.20 127.38 1wfz s ILE 49 Ca -0.01 0.27 0.03 0.00 0.00 0.00 0.00 60.65 60.94 1wfz s ILE 49 Cb -0.14 -3.50 -0.24 0.00 0.01 0.00 0.00 42.46 38.59 1wfz s ILE 49 CO 0.03 -0.38 0.39 1.33 0.00 0.00 0.00 174.94 176.32 1wfz n VAL 50 N 7.52 1.66 -4.74 2.92 0.24 -0.88 -2.75 118.33 122.30 1wfz n VAL 50 Ca 0.26 -0.72 -0.23 0.00 -2.04 0.00 0.00 64.34 61.60 1wfz n VAL 50 Cb 0.49 -1.35 -0.15 0.00 -1.47 0.00 0.00 33.84 31.36 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 -6.52 1.84 -0.11 -1.34 1.01 -1.23 -4.86 116.67 105.47 1wfz s ASP 51 Ca -0.16 -0.29 -0.10 0.00 0.71 0.00 0.00 52.55 52.72 1wfz s ASP 51 Cb 0.07 -0.20 0.03 0.00 1.01 0.00 0.00 42.92 43.83 1wfz s ASP 51 CO 0.78 0.19 0.29 0.00 0.21 0.00 0.00 175.17 176.64 1wfz s ALA 52 N -0.37 -0.71 0.12 5.23 0.00 -1.26 -0.12 121.76 124.64 1wfz s ALA 52 Ca 0.06 0.84 0.05 0.00 0.00 0.00 0.00 51.96 52.91 1wfz s ALA 52 Cb -0.06 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 1wfz s ALA 52 CO -0.01 -0.14 -0.11 1.03 0.00 0.00 0.00 175.76 176.53 1wfz s ARG 53 N 0.25 0.95 -0.05 0.00 1.81 -0.31 -4.94 118.95 116.65 1wfz s ARG 53 Ca -0.01 -1.24 0.00 0.00 -1.72 0.00 0.00 55.73 52.76 1wfz s ARG 53 Cb -0.03 -0.68 0.03 0.00 -0.45 0.00 0.00 34.95 33.82 1wfz s ARG 53 CO -0.00 0.11 -0.02 -0.59 -0.68 0.00 0.00 175.30 174.12 1wfz s PHE 54 N -2.52 0.59 -0.33 -0.53 -0.12 -1.26 -2.96 117.98 110.86 1wfz s PHE 54 Ca 0.09 -0.13 -0.01 0.00 -0.05 0.00 0.00 56.93 56.83 1wfz s PHE 54 Cb -0.02 -0.64 0.11 0.00 -0.63 0.00 0.00 43.02 41.83 1wfz s PHE 54 CO 0.01 -0.22 0.13 0.21 -0.05 0.00 0.00 175.22 175.30 1wfz s LYS 55 N 1.32 0.66 -0.03 1.99 2.47 -0.94 -4.10 119.74 121.12 1wfz s LYS 55 Ca -0.05 -1.11 0.00 0.00 -1.56 0.00 0.00 55.97 53.26 1wfz s LYS 55 Cb -0.13 -1.80 -0.03 0.00 -1.46 0.00 0.00 37.83 34.40 1wfz s LYS 55 CO -0.02 -1.04 -0.00 0.99 0.16 0.00 0.00 175.35 175.44 1wfz s THR 56 N 1.51 4.18 -0.24 3.43 2.01 -1.25 -0.37 115.64 124.91 1wfz s THR 56 Ca 0.11 -0.49 -0.01 0.00 0.31 0.00 0.00 61.69 61.61 1wfz s THR 56 Cb -0.18 -2.83 0.07 0.00 0.01 0.00 0.00 72.50 69.57 1wfz s THR 56 CO -0.22 0.45 0.02 -0.36 -0.69 0.00 0.00 174.62 173.82 1wfz s PHE 57 N -1.02 1.81 0.00 4.92 0.08 -0.63 -4.89 117.98 118.26 1wfz s PHE 57 Ca 0.17 -1.50 0.00 0.00 0.12 0.00 0.00 56.93 55.73 1wfz s PHE 57 Cb -0.11 -1.48 0.00 0.00 -0.57 0.00 0.00 43.02 40.85 1wfz s PHE 57 CO 0.08 -0.75 0.00 0.41 -0.10 0.00 0.00 175.22 174.86 1wfz n GLY 58 N 4.83 -0.01 3.43 4.36 0.00 -1.26 -1.73 105.19 114.80 1wfz n GLY 58 Ca -0.08 -0.74 -0.28 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.87 -0.15 -0.76 0.00 0.00 -2.00 -3.21 103.07 94.08 1wfz h GLY 60 Ca -0.62 0.06 0.30 0.00 0.00 0.00 0.00 47.33 47.07 1wfz h GLY 60 CO 0.48 -0.05 0.34 -1.14 0.00 0.00 0.00 176.54 176.16 1wfz n SER 61 N -4.84 0.20 -0.01 0.19 3.41 -1.26 0.17 113.62 111.47 1wfz n SER 61 Ca -0.05 1.26 -0.13 0.00 -0.26 0.00 0.00 58.87 59.70 1wfz n SER 61 Cb 0.20 -0.59 -0.09 0.00 -0.26 0.00 0.00 64.21 63.47 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 1.52 0.05 -0.56 7.33 0.00 -1.93 -0.87 119.26 124.80 1wfz h ALA 62 Ca 0.61 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 55.35 1wfz h ALA 62 Cb 1.57 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.32 1wfz h ALA 62 CO -0.61 -0.24 0.37 0.82 0.00 0.00 0.00 179.25 179.60 1wfz h ILE 63 N -0.31 1.04 0.17 0.00 2.04 0.17 -2.51 117.51 118.10 1wfz h ILE 63 Ca 0.01 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 1wfz h ILE 63 Cb 0.42 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1wfz h ILE 63 CO 0.00 0.11 -0.08 0.00 0.00 0.00 0.00 178.15 178.18 1wfz h ALA 64 N 1.68 -0.38 -1.20 1.87 0.00 -0.86 -2.80 119.26 117.58 1wfz h ALA 64 Ca 0.23 -0.05 0.44 0.00 0.00 0.00 0.00 54.91 55.53 1wfz h ALA 64 Cb 0.17 0.09 -0.14 0.00 0.00 0.00 0.00 17.79 17.90 1wfz h ALA 64 CO -0.06 -0.36 0.75 0.43 0.00 0.00 0.00 179.25 180.00 1wfz n SER 65 N -3.63 0.24 0.16 0.00 7.64 -0.34 -0.72 113.62 116.95 1wfz n SER 65 Ca -0.03 1.38 -0.07 0.00 1.01 0.00 0.00 58.87 61.17 1wfz n SER 65 Cb 0.09 -0.68 -0.03 0.00 -1.01 0.00 0.00 64.21 62.58 1wfz n SER 65 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1wfz h SER 66 N 0.00 -0.37 -0.97 6.43 4.64 -1.51 -1.08 113.55 120.70 1wfz h SER 66 Ca 0.82 0.01 0.40 0.00 -0.47 0.00 0.00 61.79 62.55 1wfz h SER 66 Cb 2.53 0.09 -0.17 0.00 -0.31 0.00 0.00 62.40 64.54 1wfz h SER 66 CO -0.52 -0.13 0.48 -1.54 -0.87 0.00 0.00 176.83 174.25 1wfz n SER 67 N -3.89 0.30 -0.02 4.97 3.41 0.10 0.13 113.62 118.62 1wfz n SER 67 Ca -0.05 1.61 -0.17 0.00 -0.26 0.00 0.00 58.87 60.00 1wfz n SER 67 Cb 0.17 -0.77 -0.09 0.00 -0.26 0.00 0.00 64.21 63.26 1wfz n SER 67 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1wfz h LEU 68 N 0.00 0.67 0.65 1.04 6.46 -1.37 -3.15 115.31 119.61 1wfz h LEU 68 Ca 0.80 -0.66 -0.03 0.00 -0.12 0.00 0.00 57.88 57.87 1wfz h LEU 68 Cb 2.10 -0.20 0.01 0.00 -0.73 0.00 0.00 40.66 41.84 1wfz h LEU 68 CO -0.76 1.23 -0.31 0.00 -0.62 0.00 0.00 178.44 177.98 1wfz h ALA 69 N 0.46 -0.98 -1.59 1.25 0.00 0.24 -1.90 119.26 116.74 1wfz h ALA 69 Ca -0.05 -0.19 0.47 0.00 0.00 0.00 0.00 54.91 55.14 1wfz h ALA 69 Cb 1.24 0.34 -0.07 0.00 0.00 0.00 0.00 17.79 19.29 1wfz h ALA 69 CO 0.12 -0.91 1.13 0.00 0.00 0.00 0.00 179.25 179.59 1wfz h THR 70 N -1.09 0.18 0.07 0.00 1.03 -0.43 1.56 112.91 114.23 1wfz h THR 70 Ca -0.09 -0.01 -0.25 0.00 -0.01 0.00 0.00 66.41 66.05 1wfz h THR 70 Cb 0.67 0.15 -0.01 0.00 -1.07 0.00 0.00 68.15 67.89 1wfz h THR 70 CO 0.15 0.00 -1.15 -0.08 -0.01 0.00 0.00 175.52 174.43 1wfz h GLU 71 N 0.02 0.16 -0.53 0.00 4.81 -1.47 -3.26 114.58 114.31 1wfz h GLU 71 Ca 0.78 -0.27 -0.04 0.00 -0.13 0.00 0.00 59.36 59.71 1wfz h GLU 71 Cb 3.03 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 32.49 1wfz h GLU 71 CO -0.07 1.12 0.19 -1.49 -0.73 0.00 0.00 179.01 178.03 1wfz h TRP 72 N 0.04 0.83 0.00 0.92 4.06 0.31 -2.46 115.95 119.64 1wfz h TRP 72 Ca -0.09 -0.07 -0.03 0.00 2.06 0.00 0.00 58.89 60.77 1wfz h TRP 72 Cb 1.89 -0.24 -0.00 0.00 -1.00 0.00 0.00 29.16 29.80 1wfz h TRP 72 CO 0.04 0.69 -0.12 -0.39 -3.56 0.00 0.00 178.44 175.10 1wfz h VAL 73 N 0.72 1.07 -3.46 1.49 -1.51 -1.47 -3.41 116.25 109.69 1wfz h VAL 73 Ca 0.17 -0.43 -0.53 0.00 -1.23 0.00 0.00 66.70 64.69 1wfz h VAL 73 Cb 0.24 1.23 0.08 0.00 -2.13 0.00 0.00 31.29 30.71 1wfz h VAL 73 CO -0.01 0.12 0.83 -0.54 -1.23 0.00 0.00 177.57 176.74 1wfz s LYS 74 N -4.76 4.16 0.00 5.19 1.02 -0.93 -2.11 119.74 122.31 1wfz s LYS 74 Ca -0.04 2.50 0.00 0.00 0.02 0.00 0.00 55.97 58.45 1wfz s LYS 74 Cb 0.16 -3.04 0.00 0.00 -0.52 0.00 0.00 37.83 34.43 1wfz s LYS 74 CO 0.69 -0.55 0.00 0.41 -0.92 0.00 0.00 175.35 174.97 1wfz n GLY 75 N 1.84 2.69 3.98 -3.33 0.00 -1.11 -4.99 105.19 104.27 1wfz n GLY 75 Ca 0.06 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 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 2.36 0.30 1.61 1.02 -0.90 -4.85 119.74 119.28 1wfz s LYS 76 Ca 0.00 -0.96 0.05 0.00 0.02 0.00 0.00 55.97 55.08 1wfz s LYS 76 Cb 0.00 -2.49 -0.02 0.00 -0.52 0.00 0.00 37.83 34.80 1wfz s LYS 76 CO 0.00 -0.85 0.43 0.95 -0.92 0.00 0.00 175.35 174.97 1wfz s THR 77 N -2.80 4.71 0.26 2.17 -4.23 -1.26 -1.58 115.64 112.90 1wfz s THR 77 Ca 0.59 -0.93 -0.04 0.00 -1.18 0.00 0.00 61.69 60.13 1wfz s THR 77 Cb -0.09 -3.66 0.28 0.00 1.34 0.00 0.00 72.50 70.37 1wfz s THR 77 CO 0.39 -0.28 1.64 -0.37 -0.54 0.00 0.00 174.62 175.47 1wfz h VAL 78 N 0.99 0.35 -0.24 2.29 -1.51 -1.91 0.67 116.25 116.90 1wfz h VAL 78 Ca -0.49 -0.05 0.03 0.00 -1.23 0.00 0.00 66.70 64.96 1wfz h VAL 78 Cb 1.24 0.19 -0.03 0.00 -2.13 0.00 0.00 31.29 30.56 1wfz h VAL 78 CO 0.58 0.03 0.04 -0.33 -1.23 0.00 0.00 177.57 176.66 1wfz h GLU 79 N 0.15 0.13 -0.66 5.19 5.08 -1.95 -1.95 114.58 120.57 1wfz h GLU 79 Ca 0.45 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.85 1wfz h GLU 79 Cb 0.82 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.99 1wfz h GLU 79 CO -0.65 0.09 0.39 0.93 -1.00 0.00 0.00 179.01 178.77 1wfz h GLU 80 N 0.14 0.71 -0.75 2.33 4.39 -1.31 -2.16 114.58 117.93 1wfz h GLU 80 Ca 0.11 -0.04 0.05 0.00 0.34 0.00 0.00 59.36 59.82 1wfz h GLU 80 Cb 0.11 -0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 28.55 1wfz h GLU 80 CO -0.15 0.47 0.45 0.00 -1.16 0.00 0.00 179.01 178.63 1wfz h ALA 81 N 1.32 1.01 -0.22 3.43 0.00 -0.67 -0.49 119.26 123.64 1wfz h ALA 81 Ca 0.29 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.26 1wfz h ALA 81 Cb 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1wfz h ALA 81 CO -0.15 0.19 0.35 -0.07 0.00 0.00 0.00 179.25 179.57 1wfz h LEU 82 N 0.85 0.00 0.00 0.00 -0.00 -0.68 0.58 115.31 116.06 1wfz h LEU 82 Ca 0.32 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 58.17 1wfz h LEU 82 Cb 0.13 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.79 1wfz h LEU 82 CO -0.16 0.00 -0.19 0.71 -0.00 0.00 0.00 178.44 178.80 1wfz h THR 83 N 0.00 0.23 -2.51 0.22 1.35 -1.06 -3.44 112.91 107.70 1wfz h THR 83 Ca 0.11 -1.33 -0.58 0.00 -0.55 0.00 0.00 66.41 64.06 1wfz h THR 83 Cb 0.81 2.09 -0.02 0.00 -1.73 0.00 0.00 68.15 69.30 1wfz h THR 83 CO -0.00 0.13 1.31 -0.63 -0.25 0.00 0.00 175.52 176.08 1wfz s ILE 84 N -3.15 3.38 0.55 6.82 1.01 0.20 -4.98 121.20 125.03 1wfz s ILE 84 Ca 0.06 0.39 0.06 0.00 0.00 0.00 0.00 60.65 61.16 1wfz s ILE 84 Cb 0.06 -3.48 0.06 0.00 0.01 0.00 0.00 42.46 39.11 1wfz s ILE 84 CO 0.70 -0.29 0.75 -0.54 0.00 0.00 0.00 174.94 175.56 1wfz s LYS 85 N 5.69 2.40 0.08 2.79 3.01 -1.26 -4.89 119.74 127.55 1wfz s LYS 85 Ca 0.84 -1.33 -0.12 0.00 -1.01 0.00 0.00 55.97 54.36 1wfz s LYS 85 Cb -0.26 -2.61 -0.23 0.00 -1.01 0.00 0.00 37.83 33.72 1wfz s LYS 85 CO 0.34 -0.75 1.17 -2.95 0.51 0.00 0.00 175.35 173.67 1wfz h ASN 86 N 0.20 0.80 -0.62 2.83 -1.07 -1.92 -3.35 115.58 112.44 1wfz h ASN 86 Ca -0.35 -0.69 0.06 0.00 0.07 0.00 0.00 56.30 55.38 1wfz h ASN 86 Cb 1.28 -0.25 -0.08 0.00 -2.07 0.00 0.00 38.32 37.20 1wfz h ASN 86 CO 0.43 1.50 -0.43 0.71 0.07 0.00 0.00 177.43 179.72 1wfz h THR 87 N 0.29 0.00 -0.81 6.14 1.35 -1.96 0.07 112.91 117.99 1wfz h THR 87 Ca -0.15 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 65.79 1wfz h THR 87 Cb 1.79 0.00 -0.10 0.00 -1.73 0.00 0.00 68.15 68.11 1wfz h THR 87 CO 0.21 0.00 -0.51 0.44 -0.25 0.00 0.00 175.52 175.42 1wfz h ASP 88 N -0.08 -1.84 0.08 5.36 3.32 -2.00 -1.62 116.42 119.64 1wfz h ASP 88 Ca 0.10 0.28 0.01 0.00 0.02 0.00 0.00 57.03 57.44 1wfz h ASP 88 Cb 0.34 0.81 -0.03 0.00 0.22 0.00 0.00 39.33 40.67 1wfz h ASP 88 CO -0.62 -0.21 -0.34 0.40 -1.72 0.00 0.00 179.24 176.74 1wfz h ILE 89 N -0.04 0.00 -0.70 0.35 2.04 -1.42 0.20 117.51 117.94 1wfz h ILE 89 Ca 0.13 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.09 1wfz h ILE 89 Cb 0.37 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.34 1wfz h ILE 89 CO -0.78 0.00 -0.29 0.00 0.00 0.00 0.00 178.15 177.08 1wfz n ALA 90 N -2.76 -0.13 0.22 1.87 0.00 -0.10 -0.33 120.51 119.30 1wfz n ALA 90 Ca -0.05 0.69 -0.14 0.00 0.00 0.00 0.00 53.44 53.93 1wfz n ALA 90 Cb 0.26 -0.29 -0.08 0.00 0.00 0.00 0.00 19.45 19.35 1wfz n ALA 90 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1wfz h LYS 91 N 0.00 -0.56 -0.95 0.00 3.64 -0.88 0.40 116.57 118.22 1wfz h LYS 91 Ca 0.23 0.04 0.23 0.00 -1.27 0.00 0.00 60.65 59.88 1wfz h LYS 91 Cb 0.40 0.13 -0.18 0.00 -0.41 0.00 0.00 32.23 32.17 1wfz h LYS 91 CO -0.69 -0.26 -0.08 -1.91 -2.27 0.00 0.00 179.45 174.24 1wfz n GLU 92 N -5.23 -0.08 0.14 1.90 4.07 0.65 0.19 120.64 122.28 1wfz n GLU 92 Ca -0.10 1.44 0.09 0.00 -0.06 0.00 0.00 57.16 58.53 1wfz n GLU 92 Cb 0.30 -2.23 0.05 0.00 -0.06 0.00 0.00 31.44 29.49 1wfz n GLU 92 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1wfz h LEU 93 N 0.00 0.00 -0.93 4.31 4.07 -0.95 -3.48 115.31 118.33 1wfz h LEU 93 Ca 0.53 0.00 -0.32 0.00 0.08 0.00 0.00 57.88 58.16 1wfz h LEU 93 Cb 0.98 0.00 0.12 0.00 1.08 0.00 0.00 40.66 42.84 1wfz h LEU 93 CO -0.92 0.12 -0.56 0.00 -1.08 0.00 0.00 178.44 175.99 1wfz s LEU 95 N -6.14 3.50 1.03 0.00 0.05 -0.85 -5.02 118.68 111.26 1wfz s LEU 95 Ca 0.45 1.89 -0.13 0.00 0.05 0.00 0.00 54.13 56.39 1wfz s LEU 95 Cb -0.20 -4.54 0.20 0.00 -2.05 0.00 0.00 46.19 39.60 1wfz s LEU 95 CO 0.60 -1.27 1.09 -2.16 -0.55 0.00 0.00 176.35 174.06 1wfz s PRO 96 N -3.99 0.21 0.39 1.48 0.04 -1.26 -4.93 135.00 126.93 1wfz s PRO 96 Ca 0.65 0.44 0.28 0.00 0.04 0.00 0.00 61.00 62.42 1wfz s PRO 96 Cb -0.18 -1.72 1.17 0.00 0.04 0.00 0.00 34.50 33.82 1wfz s PRO 96 CO 0.37 -2.86 1.84 -1.00 0.04 0.00 0.00 177.00 175.38 1wfz h PRO 97 N -1.99 0.00 0.03 0.56 0.13 -2.01 -2.83 132.00 125.89 1wfz h PRO 97 Ca -0.55 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.34 1wfz h PRO 97 Cb 1.33 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.44 1wfz h PRO 97 CO 0.56 0.00 -1.25 -0.24 -0.23 0.00 0.00 178.00 176.84 1wfz h VAL 98 N 0.00 1.44 -0.44 1.56 3.04 -2.04 -3.27 116.25 116.53 1wfz h VAL 98 Ca 0.00 -3.15 -0.14 0.00 -1.01 0.00 0.00 66.70 62.41 1wfz h VAL 98 Cb 0.42 2.76 -0.08 0.00 -2.01 0.00 0.00 31.29 32.38 1wfz h VAL 98 CO 0.00 0.85 0.17 0.29 -1.01 0.00 0.00 177.57 177.87 1wfz n LYS 99 N -3.33 2.55 -0.09 4.17 4.76 -1.07 -4.36 118.16 120.79 1wfz n LYS 99 Ca -0.07 -1.78 -0.10 0.00 -2.87 0.00 0.00 58.31 53.49 1wfz n LYS 99 Cb 0.99 -1.82 -0.03 0.00 -1.84 0.00 0.00 35.03 32.32 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 1.71 0.40 -0.98 -0.35 3.38 -1.61 -2.87 115.31 114.99 1wfz h LEU 100 Ca 0.17 -0.20 0.39 0.00 0.09 0.00 0.00 57.88 58.33 1wfz h LEU 100 Cb 1.69 -0.10 -0.15 0.00 0.09 0.00 0.00 40.66 42.19 1wfz h LEU 100 CO 0.45 0.49 0.57 0.00 0.09 0.00 0.00 178.44 180.03 1wfz n HIS 101 N -4.73 0.91 0.20 1.13 1.44 -1.26 0.32 115.22 113.23 1wfz n HIS 101 Ca -0.03 0.92 -0.13 0.00 -2.01 0.00 0.00 57.72 56.47 1wfz n HIS 101 Cb 0.16 -1.33 -0.07 0.00 0.12 0.00 0.00 29.99 28.86 1wfz n HIS 101 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1wfz n SER 103 N -5.18 -0.56 -0.10 0.00 3.41 0.15 0.66 113.62 112.00 1wfz n SER 103 Ca -0.10 1.64 -0.12 0.00 -0.26 0.00 0.00 58.87 60.04 1wfz n SER 103 Cb 0.29 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 1wfz n SER 103 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wfz h MET 104 N 0.00 0.87 -0.59 4.33 -0.00 -1.52 -3.19 114.93 114.83 1wfz h MET 104 Ca 0.35 -0.46 0.12 0.00 -0.00 0.00 0.00 59.70 59.72 1wfz h MET 104 Cb 0.59 0.02 -0.11 0.00 -0.00 0.00 0.00 31.60 32.09 1wfz h MET 104 CO -0.94 1.10 -0.10 1.25 -0.00 0.00 0.00 176.91 178.21 1wfz h LEU 105 N 0.71 -0.46 -1.17 -0.10 5.85 0.18 0.15 115.31 120.47 1wfz h LEU 105 Ca 0.06 0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.95 1wfz h LEU 105 Cb 0.97 0.33 -0.04 0.00 0.37 0.00 0.00 40.66 42.29 1wfz h LEU 105 CO 0.09 -0.17 0.56 0.00 -0.34 0.00 0.00 178.44 178.58 1wfz h ALA 106 N 1.58 1.40 0.24 1.25 0.00 -1.17 -1.21 119.26 121.35 1wfz h ALA 106 Ca 0.29 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1wfz h ALA 106 Cb 0.46 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1wfz h ALA 106 CO -0.58 0.56 -0.12 1.49 0.00 0.00 0.00 179.25 180.61 1wfz h GLU 107 N 1.15 -0.31 -0.82 0.00 4.81 -0.77 -2.54 114.58 116.10 1wfz h GLU 107 Ca 0.31 0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.60 1wfz h GLU 107 Cb -0.13 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.27 1wfz h GLU 107 CO -0.07 -0.10 0.51 0.22 -0.73 0.00 0.00 179.01 178.85 1wfz h ASP 108 N -0.48 0.83 -0.29 1.04 3.58 -0.87 -2.54 116.42 117.69 1wfz h ASP 108 Ca -0.03 0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.48 1wfz h ASP 108 Cb 0.36 -0.17 -0.06 0.00 1.72 0.00 0.00 39.33 41.18 1wfz h ASP 108 CO 0.05 0.56 -0.08 0.00 -2.88 0.00 0.00 179.24 176.89 1wfz h ALA 109 N 1.36 0.18 0.16 -0.78 0.00 -1.10 -1.56 119.26 117.52 1wfz h ALA 109 Ca 0.34 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.36 1wfz h ALA 109 Cb 0.07 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1wfz h ALA 109 CO -0.14 -0.48 -0.19 0.82 0.00 0.00 0.00 179.25 179.26 1wfz h ILE 110 N -0.02 0.00 -0.83 0.00 2.04 -1.04 -2.10 117.51 115.57 1wfz h ILE 110 Ca 0.14 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.12 1wfz h ILE 110 Cb 0.23 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.18 1wfz h ILE 110 CO -0.31 0.00 -0.44 0.11 0.00 0.00 0.00 178.15 177.51 1wfz h LYS 111 N -0.36 -0.08 -0.93 2.37 6.56 -1.42 0.49 116.57 123.20 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 0.32 0.02 -0.14 0.00 -0.57 0.00 0.00 32.23 31.87 1wfz h LYS 111 CO -0.04 -0.06 0.42 0.00 -2.06 0.00 0.00 179.45 177.71 1wfz h ALA 112 N 0.93 1.57 0.06 3.86 0.00 -1.13 0.83 119.26 125.37 1wfz h ALA 112 Ca 0.25 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.34 1wfz h ALA 112 Cb 0.55 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1wfz h ALA 112 CO -0.86 -0.43 -0.03 0.00 0.00 0.00 0.00 179.25 177.93 1wfz h ALA 113 N 1.77 -0.94 0.05 0.00 0.00 0.69 -1.00 119.26 119.83 1wfz h ALA 113 Ca 0.61 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.52 1wfz h ALA 113 Cb 1.25 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 1wfz h ALA 113 CO -0.58 -0.93 -0.53 -0.07 0.00 0.00 0.00 179.25 177.14 1wfz h LEU 114 N -0.09 -1.62 -0.28 0.00 -0.00 -1.09 -2.04 115.31 110.19 1wfz h LEU 114 Ca -0.01 0.18 0.03 0.00 -0.00 0.00 0.00 57.88 58.07 1wfz h LEU 114 Cb 0.07 0.61 -0.04 0.00 -0.00 0.00 0.00 40.66 41.30 1wfz h LEU 114 CO 0.01 -0.54 -0.20 0.00 -0.00 0.00 0.00 178.44 177.71 1wfz h ALA 115 N -0.49 -0.28 -0.93 1.53 0.00 -0.92 0.33 119.26 118.51 1wfz h ALA 115 Ca 0.00 0.03 0.18 0.00 0.00 0.00 0.00 54.91 55.12 1wfz h ALA 115 Cb 0.74 1.04 -0.17 0.00 0.00 0.00 0.00 17.79 19.39 1wfz h ALA 115 CO -0.33 -0.40 -0.26 -0.44 0.00 0.00 0.00 179.25 177.82 1wfz h ASP 116 N -0.04 -0.98 -1.00 0.00 5.19 -1.00 0.88 116.42 119.47 1wfz h ASP 116 Ca 0.04 0.28 0.09 0.00 -0.62 0.00 0.00 57.03 56.83 1wfz h ASP 116 Cb 0.16 0.61 -0.08 0.00 0.18 0.00 0.00 39.33 40.21 1wfz h ASP 116 CO -0.28 -0.31 0.64 0.22 -3.12 0.00 0.00 179.24 176.39 1wfz h TYR 117 N -0.01 1.17 -0.22 4.55 3.20 -0.28 -2.16 116.97 123.22 1wfz h TYR 117 Ca 0.42 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.27 1wfz h TYR 117 Cb 0.66 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 1wfz h TYR 117 CO -0.75 0.54 -0.09 0.87 -1.64 0.00 0.00 178.16 177.10 1wfz h LYS 118 N 1.09 0.45 -1.01 1.82 1.57 0.25 -3.03 116.57 117.70 1wfz h LYS 118 Ca 0.46 -0.19 0.31 0.00 -1.87 0.00 0.00 60.65 59.36 1wfz h LYS 118 Cb 0.31 -0.02 -0.14 0.00 0.08 0.00 0.00 32.23 32.46 1wfz h LYS 118 CO -0.22 0.71 0.58 -0.07 -0.57 0.00 0.00 179.45 179.89 1wfz h LEU 119 N 0.16 0.55 -0.72 2.94 3.38 -0.16 1.04 115.31 122.50 1wfz h LEU 119 Ca 0.05 0.18 -0.14 0.00 0.09 0.00 0.00 57.88 58.06 1wfz h LEU 119 Cb 0.57 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1wfz h LEU 119 CO 0.03 -0.08 -0.58 0.11 0.09 0.00 0.00 178.44 178.01 1wfz h LYS 120 N 0.38 0.19 0.00 1.13 1.57 -1.41 0.33 116.57 118.76 1wfz h LYS 120 Ca 0.72 -0.12 -0.19 0.00 -1.87 0.00 0.00 60.65 59.18 1wfz h LYS 120 Cb 1.60 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.91 1wfz h LYS 120 CO -0.57 0.71 -0.87 1.96 -0.57 0.00 0.00 179.45 180.12 1wfz h GLN 121 N 0.14 0.14 0.05 3.15 1.08 0.10 -3.27 115.11 116.49 1wfz h GLN 121 Ca -0.00 -0.15 -0.29 0.00 -1.45 0.00 0.00 58.65 56.75 1wfz h GLN 121 Cb 1.06 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 28.50 1wfz h GLN 121 CO 0.09 0.92 -1.57 1.05 -0.95 0.00 0.00 178.83 178.36 1wfz h GLU 122 N 0.07 0.10 -4.90 1.46 -0.00 -0.32 -3.47 114.58 107.53 1wfz h GLU 122 Ca -0.03 -0.17 -0.66 0.00 -0.00 0.00 0.00 59.36 58.49 1wfz h GLU 122 Cb 1.50 0.07 -0.02 0.00 -0.00 0.00 0.00 28.75 30.30 1wfz h GLU 122 CO 0.13 0.84 0.90 -1.13 -0.00 0.00 0.00 179.01 179.74 1wfz n SER 123 N -3.26 0.75 -4.11 3.06 3.41 0.11 -4.91 113.62 108.67 1wfz n SER 123 Ca -0.16 0.70 -0.22 0.00 -0.26 0.00 0.00 58.87 58.94 1wfz n SER 123 Cb 1.03 -0.73 -0.15 0.00 -0.26 0.00 0.00 64.21 64.10 1wfz n SER 123 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1wfz s LYS 124 N 4.04 1.12 -0.50 4.33 2.36 -1.26 -5.01 119.74 124.82 1wfz s LYS 124 Ca 0.94 -0.52 -0.17 0.00 -2.55 0.00 0.00 55.97 53.66 1wfz s LYS 124 Cb -1.23 -1.09 0.07 0.00 -1.05 0.00 0.00 37.83 34.54 1wfz s LYS 124 CO 0.59 0.30 0.51 -1.12 1.55 0.00 0.00 175.35 177.18 1wfz s SER 125 N -0.40 6.18 0.28 1.43 0.01 -1.26 -5.06 113.70 114.89 1wfz s SER 125 Ca 0.05 -1.16 0.07 0.00 1.31 0.00 0.00 55.95 56.22 1wfz s SER 125 Cb -0.06 -2.24 -0.03 0.00 0.21 0.00 0.00 66.02 63.90 1wfz s SER 125 CO -0.00 -0.78 0.21 -0.83 0.41 0.00 0.00 173.24 172.24 1wfz s GLY 126 N 2.72 1.56 0.73 3.44 0.00 -1.26 -5.11 107.32 109.40 1wfz s GLY 126 Ca 0.09 -1.53 -0.12 0.00 0.00 0.00 0.00 44.72 43.16 1wfz s GLY 126 CO 0.09 -1.53 1.10 2.56 0.00 0.00 0.00 173.10 175.32 1wfz s PRO 127 N -3.88 2.47 -0.04 2.90 0.04 -1.26 -4.91 135.00 130.32 1wfz s PRO 127 Ca 0.35 1.26 -0.37 0.00 0.04 0.00 0.00 61.00 62.29 1wfz s PRO 127 Cb -0.07 -1.92 -0.15 0.00 0.04 0.00 0.00 34.50 32.40 1wfz s PRO 127 CO 0.25 -1.49 1.61 0.43 0.04 0.00 0.00 177.00 177.84 1wfz n SER 128 N -3.08 2.49 0.07 6.66 7.64 -1.26 -4.88 113.62 121.26 1wfz n SER 128 Ca 0.10 1.07 -0.21 0.00 1.01 0.00 0.00 58.87 60.84 1wfz n SER 128 Cb 0.53 -1.26 -0.14 0.00 -1.01 0.00 0.00 64.21 62.33 1wfz n SER 128 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1wfz h SER 129 N 6.50 0.61 0.00 6.43 4.64 -2.07 -3.58 113.55 126.09 1wfz h SER 129 Ca -0.47 -0.90 0.00 0.00 -0.47 0.00 0.00 61.79 59.95 1wfz h SER 129 Cb 1.30 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1wfz h SER 129 CO 0.89 1.46 0.00 0.61 -0.87 0.00 0.00 176.83 178.91