#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 -0.20 0.00 1.61 0.01 -1.26 -5.09 113.70 108.78 1wfz s SER 2 Ca 0.00 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.57 1wfz s SER 2 Cb 0.00 0.72 0.00 0.00 0.21 0.00 0.00 66.02 66.95 1wfz s SER 2 CO 0.00 -1.36 0.00 -1.20 0.41 0.00 0.00 173.24 171.09 1wfz n SER 3 N -0.65 0.75 0.00 2.44 7.64 -1.26 -5.16 113.62 117.38 1wfz n SER 3 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.83 1wfz n SER 3 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1wfz n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wfz n GLY 4 N 2.70 2.72 3.63 0.23 0.00 -1.26 -5.00 105.19 108.21 1wfz n GLY 4 Ca 0.00 -1.54 -0.43 0.00 0.00 0.00 0.00 46.02 44.05 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 6.87 0.01 1.61 0.01 -1.26 -5.02 113.70 115.93 1wfz s SER 5 Ca 0.00 0.94 0.02 0.00 1.31 0.00 0.00 55.95 58.22 1wfz s SER 5 Cb 0.00 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.68 1wfz s SER 5 CO 0.00 -0.93 -0.07 -0.94 0.41 0.00 0.00 173.24 171.71 1wfz s SER 6 N 1.79 0.79 -0.30 2.44 1.04 -1.26 -5.06 113.70 113.13 1wfz s SER 6 Ca 0.45 -0.28 0.16 0.00 0.48 0.00 0.00 55.95 56.76 1wfz s SER 6 Cb -0.11 -0.04 0.48 0.00 0.10 0.00 0.00 66.02 66.45 1wfz s SER 6 CO 0.18 -0.03 1.09 0.61 0.98 0.00 0.00 173.24 176.07 1wfz n GLY 7 N 2.35 3.24 3.30 7.32 0.00 -1.26 -5.08 105.19 115.07 1wfz n GLY 7 Ca -0.17 -1.67 -0.18 0.00 0.00 0.00 0.00 46.02 44.01 1wfz n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wfz s GLU 8 N -3.57 1.21 0.04 1.61 2.02 -1.26 -5.16 118.70 113.59 1wfz s GLU 8 Ca 0.35 -1.48 0.06 0.00 0.02 0.00 0.00 54.97 53.92 1wfz s GLU 8 Cb 0.38 -0.99 -0.02 0.00 0.10 0.00 0.00 34.13 33.60 1wfz s GLU 8 CO -0.02 0.17 -0.17 -0.80 0.02 0.00 0.00 175.26 174.45 1wfz s ASN 9 N -3.07 2.02 0.47 -0.19 0.01 -1.26 -5.15 114.94 107.76 1wfz s ASN 9 Ca 0.18 -0.48 0.00 0.00 -0.71 0.00 0.00 52.86 51.85 1wfz s ASN 9 Cb -0.01 -0.15 0.00 0.00 0.41 0.00 0.00 41.25 41.50 1wfz s ASN 9 CO 0.05 0.09 0.00 -0.81 -1.51 0.00 0.00 177.10 174.92 1wfz n PRO 10 N 1.90 0.05 -3.76 -0.60 -0.04 -1.26 -5.10 135.00 126.20 1wfz n PRO 10 Ca -0.17 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.16 1wfz n PRO 10 Cb 0.54 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.88 1wfz n PRO 10 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1wfz s ARG 11 N -1.41 0.29 -0.54 0.54 3.52 -1.26 -4.90 118.95 115.20 1wfz s ARG 11 Ca 0.00 0.45 -0.03 0.00 -0.13 0.00 0.00 55.73 56.02 1wfz s ARG 11 Cb 0.00 0.07 0.00 0.00 -1.56 0.00 0.00 34.95 33.46 1wfz s ARG 11 CO 0.00 -0.08 0.47 0.09 -0.81 0.00 0.00 175.30 174.96 1wfz n ASN 12 N 3.38 -3.46 -4.98 -2.12 4.13 -1.26 -4.91 115.26 106.04 1wfz n ASN 12 Ca -0.17 -0.22 -0.23 0.00 1.68 0.00 0.00 54.58 55.64 1wfz n ASN 12 Cb 0.56 -2.33 0.04 0.00 -1.54 0.00 0.00 39.78 36.51 1wfz n ASN 12 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1wfz s VAL 13 N -3.13 1.87 -4.50 2.41 -7.23 -1.26 -3.80 120.40 104.75 1wfz s VAL 13 Ca 0.19 -1.21 0.00 0.00 -1.81 0.00 0.00 61.98 59.16 1wfz s VAL 13 Cb -0.09 -2.07 0.00 0.00 0.56 0.00 0.00 36.38 34.78 1wfz s VAL 13 CO 0.29 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.69 1wfz n GLY 14 N -2.07 0.93 3.44 2.32 0.00 -1.25 -4.76 105.19 103.80 1wfz n GLY 14 Ca 0.09 -1.94 -0.07 0.00 0.00 0.00 0.00 46.02 44.10 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 -4.00 -0.68 0.69 1.61 1.04 -1.26 -4.18 113.70 106.92 1wfz s SER 15 Ca 0.00 1.22 -0.07 0.00 0.48 0.00 0.00 55.95 57.59 1wfz s SER 15 Cb 0.00 1.44 0.05 0.00 0.10 0.00 0.00 66.02 67.62 1wfz s SER 15 CO 0.00 -0.22 1.01 -0.76 0.98 0.00 0.00 173.24 174.25 1wfz s LEU 16 N 2.17 2.86 -0.49 2.42 1.43 -1.26 -4.93 118.68 120.87 1wfz s LEU 16 Ca -0.06 0.53 -0.27 0.00 -1.03 0.00 0.00 54.13 53.29 1wfz s LEU 16 Cb -0.10 -3.20 -0.08 0.00 0.03 0.00 0.00 46.19 42.84 1wfz s LEU 16 CO -0.16 -1.53 2.41 -0.67 0.23 0.00 0.00 176.35 176.63 1wfz n ASP 17 N -2.90 2.27 -0.09 2.29 2.03 -1.26 -4.80 116.55 114.10 1wfz n ASP 17 Ca 0.07 -0.32 0.00 0.00 0.52 0.00 0.00 54.79 55.06 1wfz n ASP 17 Cb 0.60 -1.52 0.28 0.00 -0.72 0.00 0.00 41.12 39.76 1wfz n ASP 17 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 1wfz h LYS 18 N 18.14 0.73 -0.66 -0.67 2.10 -1.92 -2.61 116.57 131.67 1wfz h LYS 18 Ca -0.25 -0.10 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 1wfz h LYS 18 Cb 1.27 -0.14 -0.03 0.00 -0.90 0.00 0.00 32.23 32.43 1wfz h LYS 18 CO 1.15 0.59 0.43 1.79 -2.00 0.00 0.00 179.45 181.41 1wfz h THR 19 N 0.72 1.17 -1.44 0.07 1.35 -1.89 -3.42 112.91 109.49 1wfz h THR 19 Ca 0.18 -0.33 -0.65 0.00 -0.55 0.00 0.00 66.41 65.06 1wfz h THR 19 Cb 0.13 0.21 -0.01 0.00 -1.73 0.00 0.00 68.15 66.75 1wfz h THR 19 CO -0.02 0.17 1.39 -1.20 -0.25 0.00 0.00 175.52 175.61 1wfz n SER 20 N -4.61 2.58 0.22 5.36 7.64 -0.98 -4.78 113.62 119.03 1wfz n SER 20 Ca 0.05 0.43 0.15 0.00 1.01 0.00 0.00 58.87 60.52 1wfz n SER 20 Cb 0.02 -1.35 0.77 0.00 -1.01 0.00 0.00 64.21 62.64 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 0.00 1.43 -0.00 -1.87 -0.64 116.57 128.12 1wfz h LYS 21 Ca -0.34 0.00 -0.09 0.00 -0.00 0.00 0.00 60.65 60.22 1wfz h LYS 21 Cb 1.29 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.51 1wfz h LYS 21 CO 0.99 0.00 -0.44 -2.95 -0.00 0.00 0.00 179.45 177.05 1wfz h ASN 22 N 0.00 0.00 -3.35 7.07 -1.07 -1.87 -3.43 115.58 112.94 1wfz h ASN 22 Ca 0.00 0.00 -0.65 0.00 0.07 0.00 0.00 56.30 55.72 1wfz h ASN 22 Cb 0.06 0.00 -0.27 0.00 -2.07 0.00 0.00 38.32 36.05 1wfz h ASN 22 CO 0.00 0.44 -0.73 0.54 0.07 0.00 0.00 177.43 177.75 1wfz s VAL 23 N -3.52 3.34 0.57 6.14 0.11 -0.25 -0.65 120.40 126.14 1wfz s VAL 23 Ca 0.00 -0.53 -0.05 0.00 -2.93 0.00 0.00 61.98 58.47 1wfz s VAL 23 Cb 0.11 -2.47 0.01 0.00 -1.53 0.00 0.00 36.38 32.49 1wfz s VAL 23 CO 0.71 0.47 0.88 -0.83 -3.33 0.00 0.00 175.10 172.99 1wfz s GLY 24 N 0.93 1.60 -0.24 6.54 0.00 -0.42 -4.73 107.32 111.00 1wfz s GLY 24 Ca -0.01 -0.72 -0.03 0.00 0.00 0.00 0.00 44.72 43.96 1wfz s GLY 24 CO 0.00 -0.45 0.07 -1.59 0.00 0.00 0.00 173.10 171.13 1wfz s THR 25 N -2.95 0.47 -0.37 0.90 2.01 -1.26 -2.83 115.64 111.62 1wfz s THR 25 Ca 0.53 -0.79 -0.08 0.00 0.31 0.00 0.00 61.69 61.66 1wfz s THR 25 Cb -0.10 -1.16 0.05 0.00 0.01 0.00 0.00 72.50 71.29 1wfz s THR 25 CO 0.45 -0.44 0.16 -0.83 -0.69 0.00 0.00 174.62 173.27 1wfz s GLY 26 N 1.86 1.89 -0.29 4.40 0.00 -0.05 -4.67 107.32 110.46 1wfz s GLY 26 Ca 0.04 -1.83 -0.07 0.00 0.00 0.00 0.00 44.72 42.85 1wfz s GLY 26 CO -0.18 0.84 0.09 -2.27 0.00 0.00 0.00 173.10 171.57 1wfz s LEU 27 N 1.44 3.79 -0.06 0.66 2.96 -1.26 0.21 118.68 126.43 1wfz s LEU 27 Ca 0.00 -0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 53.31 1wfz s LEU 27 Cb -0.20 -1.90 0.03 0.00 0.50 0.00 0.00 46.19 44.61 1wfz s LEU 27 CO 0.04 -0.16 -0.00 0.68 -1.32 0.00 0.00 176.35 175.58 1wfz s VAL 28 N 1.53 0.33 0.42 1.68 -7.23 -0.41 -5.00 120.40 111.73 1wfz s VAL 28 Ca 0.04 0.10 0.04 0.00 -1.81 0.00 0.00 61.98 60.34 1wfz s VAL 28 Cb -0.17 -0.47 -0.04 0.00 0.56 0.00 0.00 36.38 36.27 1wfz s VAL 28 CO 0.03 0.23 0.05 -0.83 -0.31 0.00 0.00 175.10 174.27 1wfz s GLY 29 N 1.67 2.59 -0.16 2.32 0.00 -1.26 -2.53 107.32 109.96 1wfz s GLY 29 Ca 0.00 -1.38 -0.07 0.00 0.00 0.00 0.00 44.72 43.28 1wfz s GLY 29 CO -0.04 -1.99 0.08 0.00 0.00 0.00 0.00 173.10 171.15 1wfz s ALA 30 N -3.03 3.51 0.04 3.20 0.00 -0.59 -4.87 121.76 120.01 1wfz s ALA 30 Ca 0.23 -0.73 -0.20 0.00 0.00 0.00 0.00 51.96 51.26 1wfz s ALA 30 Cb 0.05 -1.90 -0.14 0.00 0.00 0.00 0.00 23.12 21.13 1wfz s ALA 30 CO 0.12 0.32 1.34 -1.00 0.00 0.00 0.00 175.76 176.54 1wfz h PRO 31 N 6.15 0.35 0.10 0.00 0.13 -1.95 0.85 132.00 137.63 1wfz h PRO 31 Ca -0.43 -0.18 -0.01 0.00 -0.87 0.00 0.00 66.00 64.51 1wfz h PRO 31 Cb 1.18 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1wfz h PRO 31 CO 0.67 0.73 -0.05 0.00 -0.23 0.00 0.00 178.00 179.12 1wfz h ALA 32 N 0.61 -0.45 0.00 -0.56 0.00 -1.99 -3.28 119.26 113.59 1wfz h ALA 32 Ca 0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wfz h ALA 32 Cb 0.67 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1wfz h ALA 32 CO 0.04 -0.44 -0.00 0.00 0.00 0.00 0.00 179.25 178.84 1wfz n GLY 34 N -1.19 -0.24 3.91 0.00 0.00 0.24 -4.83 105.19 103.08 1wfz n GLY 34 Ca -0.03 0.03 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.88 6.09 -0.33 1.61 1.01 -0.90 -4.76 116.67 115.51 1wfz s ASP 35 Ca 0.06 0.04 -0.01 0.00 0.71 0.00 0.00 52.55 53.36 1wfz s ASP 35 Cb -0.01 -1.75 0.11 0.00 1.01 0.00 0.00 42.92 42.28 1wfz s ASP 35 CO 0.55 0.02 0.14 -0.69 0.21 0.00 0.00 175.17 175.40 1wfz s VAL 36 N -1.84 0.65 -0.34 -1.27 1.01 -0.66 -1.55 120.40 116.41 1wfz s VAL 36 Ca 0.33 -1.50 -0.10 0.00 0.00 0.00 0.00 61.98 60.72 1wfz s VAL 36 Cb -0.10 -1.49 0.01 0.00 0.00 0.00 0.00 36.38 34.79 1wfz s VAL 36 CO 0.27 -0.77 0.17 -0.32 0.00 0.00 0.00 175.10 174.46 1wfz s MET 37 N 1.44 3.12 -0.46 2.72 0.00 -1.05 -1.13 119.30 123.94 1wfz s MET 37 Ca 0.12 -0.87 -0.13 0.00 0.00 0.00 0.00 55.69 54.81 1wfz s MET 37 Cb -0.19 -3.63 0.08 0.00 0.00 0.00 0.00 34.83 31.09 1wfz s MET 37 CO -0.20 -0.53 0.35 0.21 0.00 0.00 0.00 175.02 174.85 1wfz s LYS 38 N 1.59 2.82 0.25 4.11 2.20 0.44 -1.29 119.74 129.85 1wfz s LYS 38 Ca 0.03 -1.44 -0.04 0.00 -0.36 0.00 0.00 55.97 54.17 1wfz s LYS 38 Cb -0.18 -4.00 -0.05 0.00 -1.51 0.00 0.00 37.83 32.09 1wfz s LYS 38 CO 0.06 -1.03 0.49 -1.17 -0.36 0.00 0.00 175.35 173.35 1wfz s LEU 39 N 1.54 4.13 -0.10 5.43 2.96 0.13 -1.64 118.68 131.13 1wfz s LEU 39 Ca 0.04 0.64 -0.23 0.00 -0.22 0.00 0.00 54.13 54.35 1wfz s LEU 39 Cb -0.24 -3.43 0.05 0.00 0.50 0.00 0.00 46.19 43.07 1wfz s LEU 39 CO 0.04 -0.12 0.55 -1.10 -1.32 0.00 0.00 176.35 174.40 1wfz s GLN 40 N -3.35 0.83 -0.15 1.98 -0.21 -0.56 -0.87 119.66 117.33 1wfz s GLN 40 Ca 0.42 0.34 -0.08 0.00 0.02 0.00 0.00 55.36 56.07 1wfz s GLN 40 Cb -0.11 0.39 0.05 0.00 1.00 0.00 0.00 33.01 34.34 1wfz s GLN 40 CO 0.28 -0.21 0.36 0.96 -2.12 0.00 0.00 175.29 174.57 1wfz s ILE 41 N -0.69 -0.03 -0.39 1.08 -5.25 -1.13 -1.23 121.20 113.56 1wfz s ILE 41 Ca -0.08 0.10 -0.17 0.00 -0.99 0.00 0.00 60.65 59.52 1wfz s ILE 41 Cb -0.03 -0.54 0.01 0.00 2.95 0.00 0.00 42.46 44.86 1wfz s ILE 41 CO 0.05 0.04 0.43 -1.58 -1.79 0.00 0.00 174.94 172.09 1wfz s GLN 42 N 1.28 3.29 -0.03 0.37 0.74 0.83 -1.31 119.66 124.83 1wfz s GLN 42 Ca -0.09 -0.60 -0.18 0.00 0.05 0.00 0.00 55.36 54.55 1wfz s GLN 42 Cb -0.09 -3.90 -0.05 0.00 1.10 0.00 0.00 33.01 30.07 1wfz s GLN 42 CO -0.11 -0.74 0.49 0.08 -0.55 0.00 0.00 175.29 174.46 1wfz s VAL 43 N 2.14 5.01 0.41 1.34 1.01 0.18 -1.50 120.40 128.99 1wfz s VAL 43 Ca 0.13 1.01 -0.01 0.00 0.00 0.00 0.00 61.98 63.10 1wfz s VAL 43 Cb -0.17 -3.81 0.08 0.00 0.00 0.00 0.00 36.38 32.48 1wfz s VAL 43 CO 0.13 0.46 0.57 -0.67 0.00 0.00 0.00 175.10 175.59 1wfz n ASP 44 N 2.57 0.65 -0.32 3.32 2.03 -0.89 -4.68 116.55 119.24 1wfz n ASP 44 Ca -0.10 -1.57 -0.01 0.00 0.52 0.00 0.00 54.79 53.63 1wfz n ASP 44 Cb 0.52 -0.38 0.16 0.00 -0.72 0.00 0.00 41.12 40.70 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 1.20 0.00 -0.67 4.11 -1.98 -1.01 114.58 116.23 1wfz h GLU 45 Ca -0.19 -0.08 -0.03 0.00 0.07 0.00 0.00 59.36 59.14 1wfz h GLU 45 Cb 0.66 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1wfz h GLU 45 CO 0.19 0.80 -0.13 0.87 0.07 0.00 0.00 179.01 180.81 1wfz h LYS 46 N 1.24 0.00 0.00 1.06 1.57 -2.03 -3.46 116.57 114.94 1wfz h LYS 46 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1wfz h LYS 46 Cb -0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.17 1wfz h LYS 46 CO -0.07 0.13 0.00 0.41 -0.57 0.00 0.00 179.45 179.35 1wfz n GLY 47 N -0.25 0.91 3.71 3.86 0.00 -0.38 -5.09 105.19 107.95 1wfz n GLY 47 Ca -0.01 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.30 2.99 -0.31 1.61 2.36 -1.26 -3.26 119.74 121.58 1wfz s LYS 48 Ca 0.00 -0.43 -0.29 0.00 -2.55 0.00 0.00 55.97 52.70 1wfz s LYS 48 Cb 0.00 -2.81 -0.00 0.00 -1.05 0.00 0.00 37.83 33.97 1wfz s LYS 48 CO 0.00 0.69 1.43 0.42 1.55 0.00 0.00 175.35 179.44 1wfz s ILE 49 N -0.98 3.94 -0.13 5.43 1.01 -0.49 -2.09 121.20 127.89 1wfz s ILE 49 Ca 0.16 1.03 0.17 0.00 0.00 0.00 0.00 60.65 62.01 1wfz s ILE 49 Cb -0.11 -4.04 -0.23 0.00 0.01 0.00 0.00 42.46 38.09 1wfz s ILE 49 CO 0.06 -0.50 0.45 1.33 0.00 0.00 0.00 174.94 176.27 1wfz n VAL 50 N 6.54 1.18 -3.95 2.92 0.24 -0.56 -2.48 118.33 122.22 1wfz n VAL 50 Ca 0.17 -0.75 -0.10 0.00 -2.04 0.00 0.00 64.34 61.62 1wfz n VAL 50 Cb 0.47 -0.58 -0.12 0.00 -1.47 0.00 0.00 33.84 32.14 1wfz n VAL 50 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1wfz s ASP 51 N -5.54 0.18 -0.20 -1.34 -1.08 -1.24 -4.88 116.67 102.57 1wfz s ASP 51 Ca -0.07 -0.37 -0.12 0.00 -0.52 0.00 0.00 52.55 51.47 1wfz s ASP 51 Cb 0.08 0.08 0.06 0.00 -1.46 0.00 0.00 42.92 41.69 1wfz s ASP 51 CO 0.84 -0.23 0.50 0.00 0.52 0.00 0.00 175.17 176.79 1wfz s ALA 52 N -1.12 -1.31 0.25 3.66 0.00 -1.26 -0.12 121.76 121.87 1wfz s ALA 52 Ca -0.12 1.79 0.11 0.00 0.00 0.00 0.00 51.96 53.73 1wfz s ALA 52 Cb -0.08 -1.07 -0.05 0.00 0.00 0.00 0.00 23.12 21.93 1wfz s ALA 52 CO -0.01 -0.30 -0.18 1.03 0.00 0.00 0.00 175.76 176.30 1wfz s ARG 53 N 1.38 1.56 -0.12 0.00 1.81 -0.37 -4.95 118.95 118.27 1wfz s ARG 53 Ca -0.09 -1.70 -0.08 0.00 -1.72 0.00 0.00 55.73 52.14 1wfz s ARG 53 Cb -0.07 -1.56 0.04 0.00 -0.45 0.00 0.00 34.95 32.91 1wfz s ARG 53 CO -0.14 0.28 0.29 -0.59 -0.68 0.00 0.00 175.30 174.46 1wfz s PHE 54 N -2.64 -0.36 -0.31 -0.53 -0.12 -1.25 -1.50 117.98 111.27 1wfz s PHE 54 Ca 0.27 0.85 -0.02 0.00 -0.05 0.00 0.00 56.93 57.98 1wfz s PHE 54 Cb -0.04 0.11 0.10 0.00 -0.63 0.00 0.00 43.02 42.56 1wfz s PHE 54 CO 0.12 -0.21 0.12 0.21 -0.05 0.00 0.00 175.22 175.41 1wfz s LYS 55 N 0.79 0.55 -0.11 1.99 2.47 -0.65 -3.75 119.74 121.02 1wfz s LYS 55 Ca -0.05 -0.93 -0.06 0.00 -1.56 0.00 0.00 55.97 53.36 1wfz s LYS 55 Cb -0.06 -1.69 -0.04 0.00 -1.46 0.00 0.00 37.83 34.58 1wfz s LYS 55 CO -0.05 -1.01 0.14 0.99 0.16 0.00 0.00 175.35 175.58 1wfz s THR 56 N 1.72 5.47 -0.24 3.43 2.01 -1.25 -0.42 115.64 126.36 1wfz s THR 56 Ca 0.10 0.16 -0.01 0.00 0.31 0.00 0.00 61.69 62.26 1wfz s THR 56 Cb -0.17 -3.40 0.07 0.00 0.01 0.00 0.00 72.50 69.01 1wfz s THR 56 CO -0.27 0.59 0.01 -0.36 -0.69 0.00 0.00 174.62 173.90 1wfz s PHE 57 N -1.06 1.80 0.00 4.92 0.08 -0.28 -4.91 117.98 118.54 1wfz s PHE 57 Ca 0.16 -1.46 0.00 0.00 0.12 0.00 0.00 56.93 55.75 1wfz s PHE 57 Cb -0.12 -1.45 0.00 0.00 -0.57 0.00 0.00 43.02 40.88 1wfz s PHE 57 CO 0.05 -0.74 0.00 0.41 -0.10 0.00 0.00 175.22 174.85 1wfz n GLY 58 N 4.83 0.20 3.76 4.36 0.00 -1.26 -1.65 105.19 115.43 1wfz n GLY 58 Ca -0.08 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.71 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 0.74 0.10 -1.50 0.00 0.00 -1.99 -2.51 103.07 97.91 1wfz h GLY 60 Ca -0.50 -0.04 0.43 0.00 0.00 0.00 0.00 47.33 47.23 1wfz h GLY 60 CO 0.55 0.04 1.23 1.44 0.00 0.00 0.00 176.54 179.80 1wfz n SER 61 N -5.01 0.00 0.07 0.19 7.64 -1.26 0.24 113.62 115.48 1wfz n SER 61 Ca -0.06 0.82 -0.23 0.00 1.01 0.00 0.00 58.87 60.42 1wfz n SER 61 Cb 0.06 -0.37 -0.15 0.00 -1.01 0.00 0.00 64.21 62.73 1wfz n SER 61 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wfz h ALA 62 N 0.75 0.06 -0.33 -0.43 0.00 -1.80 -2.90 119.26 114.61 1wfz h ALA 62 Ca 0.71 -1.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1wfz h ALA 62 Cb 3.16 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 21.29 1wfz h ALA 62 CO -0.01 0.81 0.16 0.82 0.00 0.00 0.00 179.25 181.03 1wfz h ILE 63 N -0.06 1.11 0.13 0.00 2.04 0.31 -2.45 117.51 118.59 1wfz h ILE 63 Ca -0.29 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 1wfz h ILE 63 Cb 1.96 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.73 1wfz h ILE 63 CO 0.16 0.13 -0.06 0.00 0.00 0.00 0.00 178.15 178.38 1wfz h ALA 64 N 1.73 -0.17 -0.66 1.87 0.00 -1.34 -2.67 119.26 118.02 1wfz h ALA 64 Ca 0.12 -0.13 0.19 0.00 0.00 0.00 0.00 54.91 55.09 1wfz h ALA 64 Cb 0.04 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1wfz h ALA 64 CO -0.02 -0.18 0.78 1.03 0.00 0.00 0.00 179.25 180.86 1wfz h SER 65 N -1.01 0.00 0.00 0.00 0.87 -1.46 -1.58 113.55 110.37 1wfz h SER 65 Ca -0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1wfz h SER 65 Cb 0.32 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1wfz h SER 65 CO 0.03 0.00 -0.07 0.77 -0.53 0.00 0.00 176.83 177.03 1wfz h SER 66 N 0.00 0.00 -1.52 6.23 4.64 -1.48 -2.60 113.55 118.81 1wfz h SER 66 Ca 0.31 0.00 0.48 0.00 -0.47 0.00 0.00 61.79 62.12 1wfz h SER 66 Cb 1.87 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.85 1wfz h SER 66 CO -0.00 0.40 1.03 -1.28 -0.87 0.00 0.00 176.83 176.10 1wfz h SER 67 N -0.73 0.15 0.17 4.97 0.87 -0.94 0.88 113.55 118.91 1wfz h SER 67 Ca 0.00 0.10 -0.22 0.00 -1.23 0.00 0.00 61.79 60.44 1wfz h SER 67 Cb 0.07 0.10 0.03 0.00 -0.44 0.00 0.00 62.40 62.15 1wfz h SER 67 CO 0.00 -0.15 -0.96 0.25 -0.53 0.00 0.00 176.83 175.44 1wfz h LEU 68 N 0.03 0.55 -0.54 2.23 6.46 -1.51 -1.78 115.31 120.75 1wfz h LEU 68 Ca 0.86 -0.95 0.00 0.00 -0.12 0.00 0.00 57.88 57.68 1wfz h LEU 68 Cb 2.98 -0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 42.71 1wfz h LEU 68 CO -0.30 1.46 0.35 0.00 -0.62 0.00 0.00 178.44 179.33 1wfz h ALA 69 N 0.10 0.69 -0.09 1.25 0.00 0.10 -1.95 119.26 119.36 1wfz h ALA 69 Ca -0.17 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 1wfz h ALA 69 Cb 1.76 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 19.33 1wfz h ALA 69 CO 0.18 0.14 -0.44 1.15 0.00 0.00 0.00 179.25 180.28 1wfz h THR 70 N 0.73 1.39 0.00 0.00 2.02 -0.82 -2.90 112.91 113.33 1wfz h THR 70 Ca 0.20 -1.80 0.00 0.00 0.77 0.00 0.00 66.41 65.58 1wfz h THR 70 Cb -0.06 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.60 1wfz h THR 70 CO -0.04 0.53 0.00 1.21 0.37 0.00 0.00 175.52 177.59 1wfz n GLU 71 N -4.30 0.03 -0.09 6.66 2.13 -0.67 -2.09 120.64 122.32 1wfz n GLU 71 Ca -0.08 0.34 -0.23 0.00 0.66 0.00 0.00 57.16 57.85 1wfz n GLU 71 Cb 0.57 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 30.66 1wfz n GLU 71 CO 0.00 0.00 0.00 0.91 -0.41 0.00 0.00 177.13 177.63 1wfz n TRP 72 N -1.40 0.60 0.25 4.31 7.02 -0.75 -4.24 117.44 123.23 1wfz n TRP 72 Ca 0.01 0.18 0.15 0.00 -1.02 0.00 0.00 57.50 56.82 1wfz n TRP 72 Cb 0.04 -1.07 0.82 0.00 -2.42 0.00 0.00 31.31 28.69 1wfz n TRP 72 CO 0.00 0.00 0.00 -0.39 -2.02 0.00 0.00 177.69 175.28 1wfz h VAL 73 N -0.48 0.61 -2.65 -0.99 -1.51 -1.22 -3.40 116.25 106.60 1wfz h VAL 73 Ca -0.51 0.00 -0.52 0.00 -1.23 0.00 0.00 66.70 64.43 1wfz h VAL 73 Cb 1.72 0.94 0.06 0.00 -2.13 0.00 0.00 31.29 31.87 1wfz h VAL 73 CO -0.16 0.00 1.00 0.29 -1.23 0.00 0.00 177.57 177.48 1wfz n LYS 74 N -4.00 2.76 0.00 5.19 5.02 -1.12 -1.34 118.16 124.67 1wfz n LYS 74 Ca -0.01 1.00 0.00 0.00 -2.02 0.00 0.00 58.31 57.28 1wfz n LYS 74 Cb 0.19 -2.84 0.00 0.00 -0.02 0.00 0.00 35.03 32.36 1wfz n LYS 74 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wfz n GLY 75 N 3.91 3.14 3.98 0.72 0.00 -1.03 -5.01 105.19 110.90 1wfz n GLY 75 Ca 0.16 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.31 2.88 0.11 1.61 1.02 -0.45 -4.83 119.74 119.77 1wfz s LYS 76 Ca 0.00 -0.83 -0.00 0.00 0.02 0.00 0.00 55.97 55.15 1wfz s LYS 76 Cb 0.00 -2.64 -0.04 0.00 -0.52 0.00 0.00 37.83 34.63 1wfz s LYS 76 CO 0.00 -0.32 0.27 0.95 -0.92 0.00 0.00 175.35 175.33 1wfz s THR 77 N -2.49 5.32 0.35 2.17 -4.23 -1.26 -1.40 115.64 114.10 1wfz s THR 77 Ca 0.51 -0.39 0.16 0.00 -1.18 0.00 0.00 61.69 60.79 1wfz s THR 77 Cb -0.10 -3.67 0.36 0.00 1.34 0.00 0.00 72.50 70.43 1wfz s THR 77 CO 0.36 0.03 1.59 -0.37 -0.54 0.00 0.00 174.62 175.69 1wfz h VAL 78 N 1.90 0.06 -0.56 2.29 -1.51 -1.92 0.91 116.25 117.42 1wfz h VAL 78 Ca -0.46 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 1wfz h VAL 78 Cb 1.17 -0.00 -0.03 0.00 -2.13 0.00 0.00 31.29 30.30 1wfz h VAL 78 CO 0.73 0.01 0.36 -0.33 -1.23 0.00 0.00 177.57 177.10 1wfz h GLU 79 N 0.06 0.74 0.23 5.19 5.08 -1.94 -2.40 114.58 121.54 1wfz h GLU 79 Ca 0.78 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 59.07 1wfz h GLU 79 Cb 1.94 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 31.03 1wfz h GLU 79 CO -0.77 0.51 -0.11 0.93 -1.00 0.00 0.00 179.01 178.57 1wfz h GLU 80 N 0.75 -0.30 -0.80 2.33 4.39 0.43 -2.96 114.58 118.43 1wfz h GLU 80 Ca 0.20 0.02 0.18 0.00 0.34 0.00 0.00 59.36 60.11 1wfz h GLU 80 Cb -0.06 0.07 -0.12 0.00 -0.10 0.00 0.00 28.75 28.54 1wfz h GLU 80 CO -0.04 -0.11 0.22 0.00 -1.16 0.00 0.00 179.01 177.92 1wfz h ALA 81 N 0.31 1.10 -0.78 3.43 0.00 -1.19 0.39 119.26 122.53 1wfz h ALA 81 Ca -0.03 0.18 0.17 0.00 0.00 0.00 0.00 54.91 55.23 1wfz h ALA 81 Cb 0.33 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1wfz h ALA 81 CO 0.05 -0.36 0.52 -0.07 0.00 0.00 0.00 179.25 179.40 1wfz h LEU 82 N 0.28 0.31 -1.00 0.00 -0.00 -1.26 0.40 115.31 114.04 1wfz h LEU 82 Ca 0.47 0.02 -0.04 0.00 -0.00 0.00 0.00 57.88 58.33 1wfz h LEU 82 Cb 0.84 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 41.46 1wfz h LEU 82 CO -0.55 0.15 -0.17 0.71 -0.00 0.00 0.00 178.44 178.58 1wfz h THR 83 N 0.33 0.40 -2.04 0.22 1.35 -0.18 -3.44 112.91 109.56 1wfz h THR 83 Ca 0.39 -1.05 -0.58 0.00 -0.55 0.00 0.00 66.41 64.61 1wfz h THR 83 Cb 1.02 1.78 0.01 0.00 -1.73 0.00 0.00 68.15 69.23 1wfz h THR 83 CO -0.11 0.17 1.30 -0.38 -0.25 0.00 0.00 175.52 176.26 1wfz n ILE 84 N -3.28 0.54 -3.10 6.82 5.41 0.14 -4.97 119.36 120.92 1wfz n ILE 84 Ca 0.01 -0.25 -0.23 0.00 1.00 0.00 0.00 62.75 63.28 1wfz n ILE 84 Cb 0.43 -2.23 0.01 0.00 -0.71 0.00 0.00 39.64 37.14 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 5.15 3.16 -0.07 0.38 -0.14 -1.26 -4.98 119.74 121.97 1wfz s LYS 85 Ca 0.96 -0.49 -0.15 0.00 -1.36 0.00 0.00 55.97 54.92 1wfz s LYS 85 Cb -0.51 -2.60 -0.29 0.00 -1.68 0.00 0.00 37.83 32.75 1wfz s LYS 85 CO 0.43 -0.16 0.66 -2.95 -0.76 0.00 0.00 175.35 172.58 1wfz h ASN 86 N 0.51 0.49 -1.27 2.83 -1.07 -1.93 -3.34 115.58 111.80 1wfz h ASN 86 Ca -0.47 -0.90 0.39 0.00 0.07 0.00 0.00 56.30 55.39 1wfz h ASN 86 Cb 1.25 -0.16 -0.10 0.00 -2.07 0.00 0.00 38.32 37.23 1wfz h ASN 86 CO 0.58 1.65 0.84 0.00 0.07 0.00 0.00 177.43 180.57 1wfz h THR 87 N -0.17 0.26 -0.15 6.14 1.03 -1.96 0.41 112.91 118.47 1wfz h THR 87 Ca -0.29 -0.05 -0.03 0.00 -0.01 0.00 0.00 66.41 66.02 1wfz h THR 87 Cb 1.87 0.10 -0.00 0.00 -1.07 0.00 0.00 68.15 69.04 1wfz h THR 87 CO 0.12 0.03 -0.03 0.44 -0.01 0.00 0.00 175.52 176.07 1wfz h ASP 88 N 0.16 0.29 0.77 0.00 5.19 -2.00 -3.07 116.42 117.76 1wfz h ASP 88 Ca 0.73 -0.36 -0.03 0.00 -0.62 0.00 0.00 57.03 56.75 1wfz h ASP 88 Cb 2.32 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 41.75 1wfz h ASP 88 CO -0.30 0.58 -0.47 0.40 -3.12 0.00 0.00 179.24 176.33 1wfz h ILE 89 N 0.00 0.00 -0.94 0.35 2.04 -0.35 0.12 117.51 118.73 1wfz h ILE 89 Ca 0.04 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.04 1wfz h ILE 89 Cb 0.45 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.38 1wfz h ILE 89 CO 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 178.15 177.76 1wfz n ALA 90 N -2.70 -0.20 -0.23 1.87 0.00 -0.79 0.63 120.51 119.09 1wfz n ALA 90 Ca -0.14 0.92 -0.08 0.00 0.00 0.00 0.00 53.44 54.14 1wfz n ALA 90 Cb 0.48 -0.37 0.04 0.00 0.00 0.00 0.00 19.45 19.59 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 1.06 -0.36 0.00 3.64 -1.42 0.31 116.57 119.79 1wfz h LYS 91 Ca 0.30 -0.27 0.06 0.00 -1.27 0.00 0.00 60.65 59.47 1wfz h LYS 91 Cb 0.53 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.17 1wfz h LYS 91 CO -0.93 0.96 0.05 1.49 -2.27 0.00 0.00 179.45 178.76 1wfz h GLU 92 N 0.98 0.16 0.00 1.90 4.57 0.30 -1.63 114.58 120.87 1wfz h GLU 92 Ca 0.20 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.37 1wfz h GLU 92 Cb 0.39 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.95 1wfz h GLU 92 CO 0.01 0.11 -0.15 -0.07 -1.18 0.00 0.00 179.01 177.73 1wfz h LEU 93 N 0.17 0.00 -0.24 1.64 4.07 -0.58 -3.48 115.31 116.90 1wfz h LEU 93 Ca 0.18 0.00 -0.32 0.00 0.08 0.00 0.00 57.88 57.81 1wfz h LEU 93 Cb 0.21 0.00 0.09 0.00 1.08 0.00 0.00 40.66 42.04 1wfz h LEU 93 CO -0.25 0.02 -0.52 0.00 -1.08 0.00 0.00 178.44 176.61 1wfz s LEU 95 N -5.82 3.67 1.02 0.00 0.05 -1.06 -5.03 118.68 111.49 1wfz s LEU 95 Ca 0.38 1.81 -0.13 0.00 0.05 0.00 0.00 54.13 56.25 1wfz s LEU 95 Cb -0.17 -4.54 0.20 0.00 -2.05 0.00 0.00 46.19 39.63 1wfz s LEU 95 CO 0.47 -0.90 1.09 -2.16 -0.55 0.00 0.00 176.35 174.31 1wfz s PRO 96 N -3.72 0.29 0.04 1.48 0.04 -1.26 -4.92 135.00 126.95 1wfz s PRO 96 Ca 0.64 0.48 0.16 0.00 0.04 0.00 0.00 61.00 62.31 1wfz s PRO 96 Cb -0.15 -1.72 0.67 0.00 0.04 0.00 0.00 34.50 33.34 1wfz s PRO 96 CO 0.29 -2.82 1.50 -0.35 0.04 0.00 0.00 177.00 175.65 1wfz n PRO 97 N -4.23 0.03 0.02 0.56 -0.04 -1.26 -2.54 135.00 127.55 1wfz n PRO 97 Ca 0.05 0.29 -0.12 0.00 -0.04 0.00 0.00 63.50 63.67 1wfz n PRO 97 Cb 0.57 -1.56 -0.14 0.00 -0.04 0.00 0.00 33.50 32.33 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 1.06 -0.86 0.52 3.04 -2.04 -3.33 116.25 114.64 1wfz h VAL 98 Ca 0.00 -2.81 -0.43 0.00 -1.01 0.00 0.00 66.70 62.44 1wfz h VAL 98 Cb 0.26 2.61 -0.26 0.00 -2.01 0.00 0.00 31.29 31.89 1wfz h VAL 98 CO 0.00 0.72 0.55 0.29 -1.01 0.00 0.00 177.57 178.12 1wfz n LYS 99 N -3.27 2.25 -0.09 4.17 4.76 -1.05 -4.51 118.16 120.42 1wfz n LYS 99 Ca -0.15 -2.67 -0.11 0.00 -2.87 0.00 0.00 58.31 52.51 1wfz n LYS 99 Cb 1.03 -2.05 -0.04 0.00 -1.84 0.00 0.00 35.03 32.13 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 1.15 0.41 -1.44 -0.35 3.38 -1.67 -2.86 115.31 113.93 1wfz h LEU 100 Ca 0.53 -0.25 0.47 0.00 0.09 0.00 0.00 57.88 58.71 1wfz h LEU 100 Cb 2.61 -0.11 -0.11 0.00 0.09 0.00 0.00 40.66 43.15 1wfz h LEU 100 CO 0.95 0.56 0.97 0.00 0.09 0.00 0.00 178.44 181.01 1wfz n HIS 101 N -4.68 0.42 0.36 1.13 1.44 -1.26 0.50 115.22 113.13 1wfz n HIS 101 Ca -0.03 0.43 -0.17 0.00 -2.01 0.00 0.00 57.72 55.93 1wfz n HIS 101 Cb 0.20 -0.86 -0.09 0.00 0.12 0.00 0.00 29.99 29.36 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 -0.95 -1.25 -0.80 0.00 0.02 -0.10 0.29 113.55 110.77 1wfz h SER 103 Ca -0.09 0.18 0.09 0.00 -0.84 0.00 0.00 61.79 61.13 1wfz h SER 103 Cb 0.70 0.54 -0.07 0.00 0.14 0.00 0.00 62.40 63.71 1wfz h SER 103 CO 0.15 -0.18 0.45 0.00 -1.14 0.00 0.00 176.83 176.11 1wfz h MET 104 N -0.09 0.74 -0.94 3.45 -0.00 -1.57 -0.99 114.93 115.53 1wfz h MET 104 Ca 0.08 -0.04 0.10 0.00 -0.00 0.00 0.00 59.70 59.83 1wfz h MET 104 Cb 0.29 -0.17 -0.07 0.00 -0.00 0.00 0.00 31.60 31.65 1wfz h MET 104 CO -0.49 0.49 0.60 1.25 -0.00 0.00 0.00 176.91 178.75 1wfz h LEU 105 N 0.76 0.87 -0.40 -0.10 5.85 0.82 0.15 115.31 123.26 1wfz h LEU 105 Ca 0.38 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 59.11 1wfz h LEU 105 Cb 0.35 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1wfz h LEU 105 CO -0.24 0.51 0.20 0.00 -0.34 0.00 0.00 178.44 178.56 1wfz h ALA 106 N 1.53 0.51 0.49 1.25 0.00 0.82 -2.61 119.26 121.25 1wfz h ALA 106 Ca 0.44 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.22 1wfz h ALA 106 Cb 0.38 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1wfz h ALA 106 CO -0.19 0.06 -0.23 1.49 0.00 0.00 0.00 179.25 180.37 1wfz h GLU 107 N 0.50 -0.63 -1.02 0.00 4.57 -1.07 -3.05 114.58 113.88 1wfz h GLU 107 Ca 0.14 0.04 0.41 0.00 -1.18 0.00 0.00 59.36 58.77 1wfz h GLU 107 Cb 0.11 0.14 -0.17 0.00 -0.16 0.00 0.00 28.75 28.67 1wfz h GLU 107 CO -0.02 -0.41 0.57 -0.25 -1.18 0.00 0.00 179.01 177.73 1wfz n ASP 108 N -5.21 0.32 0.02 1.04 9.92 0.43 0.83 116.55 123.89 1wfz n ASP 108 Ca -0.08 1.55 -0.13 0.00 -0.53 0.00 0.00 54.79 55.60 1wfz n ASP 108 Cb 0.27 -0.76 -0.08 0.00 -0.64 0.00 0.00 41.12 39.90 1wfz n ASP 108 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wfz h ALA 109 N 1.86 -0.02 0.03 2.24 0.00 -1.46 -2.57 119.26 119.33 1wfz h ALA 109 Ca 0.82 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.62 1wfz h ALA 109 Cb 2.25 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 20.02 1wfz h ALA 109 CO -0.69 -0.40 -0.32 0.82 0.00 0.00 0.00 179.25 178.66 1wfz h ILE 110 N -0.26 0.00 -0.49 0.00 2.04 0.54 -2.34 117.51 117.00 1wfz h ILE 110 Ca -0.00 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.92 1wfz h ILE 110 Cb 0.25 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.23 1wfz h ILE 110 CO 0.00 0.00 -0.50 0.11 0.00 0.00 0.00 178.15 177.76 1wfz h LYS 111 N -0.42 -0.30 -0.99 2.37 6.56 -1.52 0.13 116.57 122.38 1wfz h LYS 111 Ca 0.00 0.02 0.36 0.00 -1.06 0.00 0.00 60.65 59.97 1wfz h LYS 111 Cb 0.44 0.07 -0.18 0.00 -0.57 0.00 0.00 32.23 31.99 1wfz h LYS 111 CO -0.20 -0.20 0.36 0.00 -2.06 0.00 0.00 179.45 177.35 1wfz h ALA 112 N 0.26 1.81 -1.51 3.86 0.00 -1.19 -0.47 119.26 122.02 1wfz h ALA 112 Ca 0.12 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1wfz h ALA 112 Cb 0.58 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1wfz h ALA 112 CO -0.64 -0.80 0.00 0.00 0.00 0.00 0.00 179.25 177.81 1wfz n ALA 113 N -2.56 -0.23 -0.32 0.00 0.00 0.43 -0.94 120.51 116.88 1wfz n ALA 113 Ca 0.32 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.75 1wfz n ALA 113 Cb 1.08 0.03 0.04 0.00 0.00 0.00 0.00 19.45 20.60 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 -1.29 -0.00 0.00 -0.00 -1.24 -1.10 115.31 111.67 1wfz h LEU 114 Ca 0.00 0.28 0.00 0.00 -0.00 0.00 0.00 57.88 58.16 1wfz h LEU 114 Cb 0.00 0.68 -0.01 0.00 -0.00 0.00 0.00 40.66 41.34 1wfz h LEU 114 CO 0.00 -0.29 -0.07 0.00 -0.00 0.00 0.00 178.44 178.07 1wfz h ALA 115 N 1.32 -0.55 -0.99 1.53 0.00 -1.13 0.66 119.26 120.09 1wfz h ALA 115 Ca 0.32 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.45 1wfz h ALA 115 Cb 0.59 0.57 -0.19 0.00 0.00 0.00 0.00 17.79 18.77 1wfz h ALA 115 CO -0.89 -0.58 -0.13 -0.44 0.00 0.00 0.00 179.25 177.22 1wfz h ASP 116 N -0.09 -0.72 -0.79 0.00 5.19 -0.31 0.95 116.42 120.64 1wfz h ASP 116 Ca 0.00 0.29 0.02 0.00 -0.62 0.00 0.00 57.03 56.72 1wfz h ASP 116 Cb 0.10 0.56 -0.04 0.00 0.18 0.00 0.00 39.33 40.12 1wfz h ASP 116 CO -0.05 -0.34 0.52 0.22 -3.12 0.00 0.00 179.24 176.47 1wfz h TYR 117 N 0.00 0.97 -0.35 4.55 3.20 -0.60 -2.61 116.97 122.13 1wfz h TYR 117 Ca 0.53 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.37 1wfz h TYR 117 Cb 0.95 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 1wfz h TYR 117 CO -0.64 0.59 0.02 0.87 -1.64 0.00 0.00 178.16 177.36 1wfz h LYS 118 N 1.03 0.61 -0.99 1.82 1.57 0.31 -2.91 116.57 118.00 1wfz h LYS 118 Ca 0.30 -0.18 0.27 0.00 -1.87 0.00 0.00 60.65 59.17 1wfz h LYS 118 Cb -0.06 -0.06 -0.13 0.00 0.08 0.00 0.00 32.23 32.06 1wfz h LYS 118 CO -0.09 0.70 0.57 -0.07 -0.57 0.00 0.00 179.45 180.00 1wfz h LEU 119 N 0.43 0.59 -1.08 2.94 3.38 -0.35 1.18 115.31 122.40 1wfz h LEU 119 Ca 0.10 0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 1wfz h LEU 119 Cb 0.41 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1wfz h LEU 119 CO 0.01 0.01 -0.26 0.11 0.09 0.00 0.00 178.44 178.40 1wfz h LYS 120 N 0.47 0.00 0.02 1.13 1.57 -1.38 -0.96 116.57 117.43 1wfz h LYS 120 Ca 0.67 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 59.24 1wfz h LYS 120 Cb 1.37 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.67 1wfz h LYS 120 CO -0.53 0.26 -0.96 1.96 -0.57 0.00 0.00 179.45 179.61 1wfz h GLN 121 N 0.00 0.14 0.00 3.15 1.08 0.14 -3.26 115.11 116.36 1wfz h GLN 121 Ca -0.00 -0.18 -0.16 0.00 -1.45 0.00 0.00 58.65 56.86 1wfz h GLN 121 Cb 0.78 0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 28.24 1wfz h GLN 121 CO 0.03 0.99 -1.10 1.05 -0.95 0.00 0.00 178.83 178.85 1wfz h GLU 122 N 0.06 0.00 -3.36 1.46 4.11 -0.99 -3.48 114.58 112.38 1wfz h GLU 122 Ca -0.05 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.34 1wfz h GLU 122 Cb 1.64 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.77 1wfz h GLU 122 CO 0.14 0.42 -0.02 0.45 0.07 0.00 0.00 179.01 180.07 1wfz s SER 123 N -6.08 -0.24 -0.10 3.06 0.15 -0.38 -5.11 113.70 104.99 1wfz s SER 123 Ca -0.00 -0.43 0.02 0.00 0.70 0.00 0.00 55.95 56.24 1wfz s SER 123 Cb 0.08 0.53 0.01 0.00 -1.71 0.00 0.00 66.02 64.94 1wfz s SER 123 CO 0.79 -0.97 -0.17 -1.59 1.20 0.00 0.00 173.24 172.50 1wfz s LYS 124 N -3.85 2.36 0.31 5.44 -2.85 -1.26 -3.80 119.74 116.09 1wfz s LYS 124 Ca 0.07 -0.62 0.08 0.00 -1.00 0.00 0.00 55.97 54.50 1wfz s LYS 124 Cb 0.00 -1.94 -0.06 0.00 -2.06 0.00 0.00 37.83 33.77 1wfz s LYS 124 CO -0.06 -0.01 -0.08 -1.54 0.10 0.00 0.00 175.35 173.76 1wfz s SER 125 N 0.82 3.22 0.97 0.03 1.04 -1.26 -5.14 113.70 113.37 1wfz s SER 125 Ca -0.10 -1.19 -0.12 0.00 0.48 0.00 0.00 55.95 55.02 1wfz s SER 125 Cb -0.16 -0.25 0.17 0.00 0.10 0.00 0.00 66.02 65.88 1wfz s SER 125 CO 0.01 -0.27 1.10 -0.83 0.98 0.00 0.00 173.24 174.23 1wfz s GLY 126 N -3.52 1.58 0.00 7.32 0.00 -1.26 -4.88 107.32 106.56 1wfz s GLY 126 Ca 0.31 -0.30 0.09 0.00 0.00 0.00 0.00 44.72 44.81 1wfz s GLY 126 CO 0.14 0.28 0.97 -1.55 0.00 0.00 0.00 173.10 172.94 1wfz n PRO 127 N -4.07 0.49 -0.95 2.90 -0.04 -1.26 -4.27 135.00 127.79 1wfz n PRO 127 Ca 0.06 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.27 1wfz n PRO 127 Cb 0.57 -1.28 -0.05 0.00 -0.04 0.00 0.00 33.50 32.69 1wfz n PRO 127 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wfz n SER 128 N -0.78 6.06 -4.37 3.54 2.88 -1.26 -4.84 113.62 114.85 1wfz n SER 128 Ca 0.07 -2.39 -0.31 0.00 -1.33 0.00 0.00 58.87 54.90 1wfz n SER 128 Cb 0.03 -1.26 -0.15 0.00 -0.75 0.00 0.00 64.21 62.08 1wfz n SER 128 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wfz s SER 129 N 2.64 3.36 0.00 -3.46 0.15 -1.26 -5.21 113.70 109.92 1wfz s SER 129 Ca 0.54 -0.43 0.04 0.00 0.70 0.00 0.00 55.95 56.80 1wfz s SER 129 Cb 0.17 -0.47 0.03 0.00 -1.71 0.00 0.00 66.02 64.05 1wfz s SER 129 CO -0.03 0.31 0.63 0.61 1.20 0.00 0.00 173.24 175.95