#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 7.11 0.04 1.61 7.64 -1.26 -4.57 113.62 124.19 1wfz n SER 2 Ca 0.00 -3.46 -0.13 0.00 1.01 0.00 0.00 58.87 56.29 1wfz n SER 2 Cb 0.00 -1.04 -0.09 0.00 -1.01 0.00 0.00 64.21 62.07 1wfz n SER 2 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1wfz h SER 3 N 1.97 -0.11 -0.42 6.43 0.02 -2.08 -3.40 113.55 115.97 1wfz h SER 3 Ca 0.46 -0.36 -0.24 0.00 -0.84 0.00 0.00 61.79 60.81 1wfz h SER 3 Cb 0.77 0.03 -0.40 0.00 0.14 0.00 0.00 62.40 62.94 1wfz h SER 3 CO 1.19 0.33 -1.12 0.61 -1.14 0.00 0.00 176.83 176.70 1wfz n GLY 4 N 0.05 1.76 0.00 -3.77 0.00 -1.26 -4.82 105.19 97.15 1wfz n GLY 4 Ca -0.09 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1wfz n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wfz n SER 5 N -0.58 3.75 -4.69 1.61 3.41 -1.26 -5.04 113.62 110.82 1wfz n SER 5 Ca 0.07 0.00 -0.53 0.00 -0.26 0.00 0.00 58.87 58.15 1wfz n SER 5 Cb 0.81 0.57 -0.06 0.00 -0.26 0.00 0.00 64.21 65.27 1wfz n SER 5 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1wfz n SER 6 N -1.36 2.85 0.00 4.04 3.41 -1.26 -4.72 113.62 116.57 1wfz n SER 6 Ca 0.00 1.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 1wfz n SER 6 Cb 0.18 -1.24 0.00 0.00 -0.26 0.00 0.00 64.21 62.88 1wfz n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wfz n GLY 7 N 4.41 3.42 3.48 5.00 0.00 -1.26 -5.01 105.19 115.23 1wfz n GLY 7 Ca 0.26 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 1wfz n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wfz n GLU 8 N 0.00 0.17 -2.31 1.61 1.02 -1.26 -4.86 120.64 115.01 1wfz n GLU 8 Ca 0.00 0.01 -0.36 0.00 -0.02 0.00 0.00 57.16 56.79 1wfz n GLU 8 Cb 0.00 -1.77 -0.01 0.00 -0.02 0.00 0.00 31.44 29.64 1wfz n GLU 8 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1wfz s ASN 9 N 9.04 5.97 1.25 1.62 4.22 -1.26 -5.04 114.94 130.75 1wfz s ASN 9 Ca 1.29 2.18 -0.21 0.00 -2.14 0.00 0.00 52.86 53.98 1wfz s ASN 9 Cb -1.14 -2.58 0.31 0.00 1.28 0.00 0.00 41.25 39.11 1wfz s ASN 9 CO 0.48 -1.05 1.09 -0.81 -2.04 0.00 0.00 177.10 174.77 1wfz n PRO 10 N -0.97 -3.16 -0.10 3.55 -0.04 -1.26 -5.04 135.00 127.98 1wfz n PRO 10 Ca 0.10 -1.74 -0.15 0.00 -0.04 0.00 0.00 63.50 61.67 1wfz n PRO 10 Cb 0.50 -1.63 -0.06 0.00 -0.04 0.00 0.00 33.50 32.27 1wfz n PRO 10 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1wfz n ARG 11 N -4.84 0.53 -1.51 0.54 3.00 -1.26 -4.69 116.66 108.43 1wfz n ARG 11 Ca 0.15 0.41 -0.23 0.00 -0.00 0.00 0.00 57.85 58.18 1wfz n ARG 11 Cb 0.59 -1.60 -0.10 0.00 0.00 0.00 0.00 32.46 31.34 1wfz n ARG 11 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1wfz n ASN 12 N -4.46 1.70 -4.27 6.15 3.02 -1.26 -4.84 115.26 111.30 1wfz n ASN 12 Ca -0.24 -2.54 -0.17 0.00 -0.03 0.00 0.00 54.58 51.59 1wfz n ASN 12 Cb 0.55 -1.53 -0.10 0.00 -0.61 0.00 0.00 39.78 38.08 1wfz n ASN 12 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1wfz s VAL 13 N 14.11 1.39 -0.32 2.41 1.01 -1.26 -3.81 120.40 133.93 1wfz s VAL 13 Ca 0.76 -1.98 -0.27 0.00 0.00 0.00 0.00 61.98 60.49 1wfz s VAL 13 Cb -0.00 -1.79 -0.12 0.00 0.00 0.00 0.00 36.38 34.47 1wfz s VAL 13 CO 0.20 -0.59 1.33 0.61 0.00 0.00 0.00 175.10 176.65 1wfz n GLY 14 N 0.01 -0.10 0.00 4.51 0.00 -1.26 -4.73 105.19 103.62 1wfz n GLY 14 Ca -0.11 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1wfz n GLY 14 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wfz n SER 15 N 4.68 0.46 -4.64 1.61 7.64 -1.26 -5.07 113.62 117.03 1wfz n SER 15 Ca 0.34 -1.19 -0.25 0.00 1.01 0.00 0.00 58.87 58.78 1wfz n SER 15 Cb -0.02 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.09 1wfz n SER 15 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1wfz s LEU 16 N -0.19 2.98 0.31 -3.43 1.43 -1.26 -5.13 118.68 113.40 1wfz s LEU 16 Ca 0.00 -1.06 -0.23 0.00 -1.03 0.00 0.00 54.13 51.81 1wfz s LEU 16 Cb 0.00 -1.30 -0.10 0.00 0.03 0.00 0.00 46.19 44.83 1wfz s LEU 16 CO 0.00 -0.31 0.88 -0.62 0.23 0.00 0.00 176.35 176.53 1wfz s ASP 17 N -3.74 7.18 0.05 2.29 2.15 -1.26 -4.97 116.67 118.37 1wfz s ASP 17 Ca 0.36 1.68 0.22 0.00 0.43 0.00 0.00 52.55 55.24 1wfz s ASP 17 Cb 0.02 -2.52 -0.20 0.00 -0.30 0.00 0.00 42.92 39.91 1wfz s ASP 17 CO 0.20 -0.09 0.67 2.29 -0.17 0.00 0.00 175.17 178.07 1wfz n LYS 18 N 0.38 0.64 -0.11 4.34 2.85 -1.26 -4.03 118.16 120.97 1wfz n LYS 18 Ca 0.02 -0.05 0.05 0.00 -1.05 0.00 0.00 58.31 57.28 1wfz n LYS 18 Cb 0.51 -1.65 0.17 0.00 -0.65 0.00 0.00 35.03 33.41 1wfz n LYS 18 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1wfz n THR 19 N -2.48 0.30 -3.04 0.58 -2.24 -1.26 -4.88 114.28 101.26 1wfz n THR 19 Ca -0.05 -0.32 -0.25 0.00 -2.27 0.00 0.00 64.05 61.17 1wfz n THR 19 Cb 0.62 0.17 -0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1wfz n THR 19 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1wfz s SER 20 N -1.10 6.12 -0.23 3.42 0.01 -1.26 -5.05 113.70 115.61 1wfz s SER 20 Ca 0.19 0.53 -0.16 0.00 1.31 0.00 0.00 55.95 57.82 1wfz s SER 20 Cb 0.10 -1.93 -0.12 0.00 0.21 0.00 0.00 66.02 64.28 1wfz s SER 20 CO 0.14 -0.51 -0.19 2.29 0.41 0.00 0.00 173.24 175.38 1wfz n LYS 21 N -2.02 0.56 -0.15 12.44 2.85 -1.26 -4.31 118.16 126.27 1wfz n LYS 21 Ca -0.01 0.36 0.29 0.00 -1.05 0.00 0.00 58.31 57.90 1wfz n LYS 21 Cb 0.56 -1.57 0.71 0.00 -0.65 0.00 0.00 35.03 34.08 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 -1.00 0.00 -3.58 -5.58 -1.07 -1.92 -3.35 115.58 99.08 1wfz h ASN 22 Ca -0.44 0.00 -0.67 0.00 0.07 0.00 0.00 56.30 55.26 1wfz h ASN 22 Cb 1.34 0.00 -0.27 0.00 -2.07 0.00 0.00 38.32 37.32 1wfz h ASN 22 CO -0.27 0.00 -0.64 0.54 0.07 0.00 0.00 177.43 177.13 1wfz s VAL 23 N -4.77 3.82 0.60 6.14 0.11 -1.26 0.19 120.40 125.23 1wfz s VAL 23 Ca -0.04 -0.69 -0.12 0.00 -2.93 0.00 0.00 61.98 58.19 1wfz s VAL 23 Cb 0.19 -2.94 -0.05 0.00 -1.53 0.00 0.00 36.38 32.05 1wfz s VAL 23 CO 0.67 0.13 1.02 -0.83 -3.33 0.00 0.00 175.10 172.76 1wfz s GLY 24 N 1.48 1.73 -0.28 6.54 0.00 -0.78 -4.63 107.32 111.38 1wfz s GLY 24 Ca 0.03 -0.05 0.01 0.00 0.00 0.00 0.00 44.72 44.71 1wfz s GLY 24 CO 0.01 0.22 0.01 -1.59 0.00 0.00 0.00 173.10 171.75 1wfz s THR 25 N -3.09 1.55 -0.37 0.90 2.01 -1.26 -2.95 115.64 112.44 1wfz s THR 25 Ca 0.56 -1.52 -0.08 0.00 0.31 0.00 0.00 61.69 60.96 1wfz s THR 25 Cb -0.11 -1.97 0.05 0.00 0.01 0.00 0.00 72.50 70.48 1wfz s THR 25 CO 0.50 -0.35 0.17 -0.83 -0.69 0.00 0.00 174.62 173.42 1wfz s GLY 26 N 1.33 1.90 -0.18 4.40 0.00 0.21 -4.55 107.32 110.44 1wfz s GLY 26 Ca 0.02 -1.86 -0.03 0.00 0.00 0.00 0.00 44.72 42.85 1wfz s GLY 26 CO -0.11 0.85 -0.06 -2.27 0.00 0.00 0.00 173.10 171.51 1wfz s LEU 27 N 1.44 2.97 -0.17 0.66 2.96 -1.26 -0.10 118.68 125.18 1wfz s LEU 27 Ca 0.01 -0.29 -0.04 0.00 -0.22 0.00 0.00 54.13 53.59 1wfz s LEU 27 Cb -0.20 -1.73 0.08 0.00 0.50 0.00 0.00 46.19 44.84 1wfz s LEU 27 CO 0.03 0.08 0.23 0.68 -1.32 0.00 0.00 176.35 176.06 1wfz s VAL 28 N 0.86 -0.36 0.48 1.68 -7.23 0.22 -4.95 120.40 111.11 1wfz s VAL 28 Ca -0.01 0.05 0.05 0.00 -1.81 0.00 0.00 61.98 60.26 1wfz s VAL 28 Cb -0.15 -0.58 -0.01 0.00 0.56 0.00 0.00 36.38 36.21 1wfz s VAL 28 CO 0.01 -0.07 0.23 -0.83 -0.31 0.00 0.00 175.10 174.13 1wfz s GLY 29 N 2.36 2.50 -0.15 2.32 0.00 -1.26 -2.69 107.32 110.40 1wfz s GLY 29 Ca 0.05 -1.40 -0.06 0.00 0.00 0.00 0.00 44.72 43.31 1wfz s GLY 29 CO -0.11 -1.98 0.05 0.00 0.00 0.00 0.00 173.10 171.06 1wfz s ALA 30 N -2.72 3.42 -0.01 3.20 0.00 -0.82 -4.87 121.76 119.96 1wfz s ALA 30 Ca 0.31 -0.75 -0.25 0.00 0.00 0.00 0.00 51.96 51.27 1wfz s ALA 30 Cb 0.01 -1.80 -0.19 0.00 0.00 0.00 0.00 23.12 21.14 1wfz s ALA 30 CO 0.18 0.35 1.28 -1.00 0.00 0.00 0.00 175.76 176.57 1wfz h PRO 31 N 6.05 0.07 0.08 0.00 0.13 -1.96 0.11 132.00 136.48 1wfz h PRO 31 Ca -0.43 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1wfz h PRO 31 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1wfz h PRO 31 CO 0.64 0.54 -0.04 0.00 -0.23 0.00 0.00 178.00 178.91 1wfz h ALA 32 N 0.53 -0.46 -0.77 -0.56 0.00 -2.00 -3.31 119.26 112.69 1wfz h ALA 32 Ca 0.00 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.00 1wfz h ALA 32 Cb 0.52 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1wfz h ALA 32 CO 0.01 -0.45 0.50 0.00 0.00 0.00 0.00 179.25 179.31 1wfz n GLY 34 N -1.46 0.56 3.69 0.00 0.00 0.00 -4.88 105.19 103.10 1wfz n GLY 34 Ca 0.13 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.07 4.61 -0.33 1.61 1.01 -1.05 -4.73 116.67 114.71 1wfz s ASP 35 Ca 0.07 -0.72 -0.01 0.00 0.71 0.00 0.00 52.55 52.60 1wfz s ASP 35 Cb -0.01 -0.79 0.11 0.00 1.01 0.00 0.00 42.92 43.25 1wfz s ASP 35 CO 0.12 -0.15 0.15 -0.69 0.21 0.00 0.00 175.17 174.81 1wfz s VAL 36 N -2.38 0.60 -0.40 -1.27 1.01 -0.65 -1.94 120.40 115.37 1wfz s VAL 36 Ca 0.34 -1.50 -0.15 0.00 0.00 0.00 0.00 61.98 60.68 1wfz s VAL 36 Cb -0.04 -1.45 0.01 0.00 0.00 0.00 0.00 36.38 34.90 1wfz s VAL 36 CO 0.21 -0.79 0.32 -0.32 0.00 0.00 0.00 175.10 174.53 1wfz s MET 37 N 1.42 3.08 -0.37 2.72 1.75 -1.10 -1.70 119.30 125.10 1wfz s MET 37 Ca 0.12 -0.91 -0.05 0.00 -1.25 0.00 0.00 55.69 53.60 1wfz s MET 37 Cb -0.19 -3.95 0.07 0.00 2.84 0.00 0.00 34.83 33.60 1wfz s MET 37 CO -0.19 -0.72 0.14 0.21 -0.65 0.00 0.00 175.02 173.81 1wfz s LYS 38 N 1.78 2.42 0.01 4.11 2.20 0.74 -0.61 119.74 130.39 1wfz s LYS 38 Ca 0.07 -1.43 -0.01 0.00 -0.36 0.00 0.00 55.97 54.23 1wfz s LYS 38 Cb -0.18 -3.51 -0.04 0.00 -1.51 0.00 0.00 37.83 32.59 1wfz s LYS 38 CO 0.11 -0.83 0.17 -1.17 -0.36 0.00 0.00 175.35 173.27 1wfz s LEU 39 N 1.31 4.26 -0.13 5.43 2.96 0.85 -1.85 118.68 131.52 1wfz s LEU 39 Ca 0.01 0.28 -0.05 0.00 -0.22 0.00 0.00 54.13 54.15 1wfz s LEU 39 Cb -0.21 -2.63 0.06 0.00 0.50 0.00 0.00 46.19 43.91 1wfz s LEU 39 CO -0.00 0.24 0.28 -1.10 -1.32 0.00 0.00 176.35 174.45 1wfz s GLN 40 N -2.06 0.18 -0.09 1.98 -0.21 -1.06 -0.62 119.66 117.78 1wfz s GLN 40 Ca 0.28 0.74 0.03 0.00 0.02 0.00 0.00 55.36 56.44 1wfz s GLN 40 Cb -0.13 -0.01 0.01 0.00 1.00 0.00 0.00 33.01 33.88 1wfz s GLN 40 CO 0.20 -0.26 -0.19 0.96 -2.12 0.00 0.00 175.29 173.88 1wfz s ILE 41 N 2.24 1.70 -0.40 1.08 -5.25 -1.15 -0.39 121.20 119.02 1wfz s ILE 41 Ca -0.01 -0.80 -0.22 0.00 -0.99 0.00 0.00 60.65 58.63 1wfz s ILE 41 Cb -0.12 -1.50 0.02 0.00 2.95 0.00 0.00 42.46 43.81 1wfz s ILE 41 CO -0.09 0.48 0.72 -1.58 -1.79 0.00 0.00 174.94 172.68 1wfz s GLN 42 N 0.57 3.54 -0.07 0.37 0.74 0.22 -1.87 119.66 123.16 1wfz s GLN 42 Ca -0.15 -0.01 -0.17 0.00 0.05 0.00 0.00 55.36 55.08 1wfz s GLN 42 Cb -0.17 -3.88 -0.05 0.00 1.10 0.00 0.00 33.01 30.02 1wfz s GLN 42 CO 0.05 -0.94 0.47 0.08 -0.55 0.00 0.00 175.29 174.40 1wfz s VAL 43 N 3.02 5.10 0.40 1.34 1.01 0.13 -1.98 120.40 129.42 1wfz s VAL 43 Ca 0.28 0.95 -0.03 0.00 0.00 0.00 0.00 61.98 63.18 1wfz s VAL 43 Cb -0.13 -3.80 0.08 0.00 0.00 0.00 0.00 36.38 32.53 1wfz s VAL 43 CO 0.19 0.41 0.54 -0.67 0.00 0.00 0.00 175.10 175.57 1wfz n ASP 44 N 3.04 0.46 -0.24 3.32 2.03 -1.10 -4.65 116.55 119.42 1wfz n ASP 44 Ca -0.09 -1.45 -0.02 0.00 0.52 0.00 0.00 54.79 53.74 1wfz n ASP 44 Cb 0.52 -0.37 0.17 0.00 -0.72 0.00 0.00 41.12 40.71 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 1.05 0.00 -0.67 4.11 -1.98 -1.58 114.58 115.51 1wfz h GLU 45 Ca -0.18 -0.13 -0.04 0.00 0.07 0.00 0.00 59.36 59.09 1wfz h GLU 45 Cb 0.59 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1wfz h GLU 45 CO 0.17 0.79 -0.18 0.87 0.07 0.00 0.00 179.01 180.72 1wfz h LYS 46 N 1.05 0.00 0.00 1.06 1.57 -2.03 -3.46 116.57 114.76 1wfz h LYS 46 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1wfz h LYS 46 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1wfz h LYS 46 CO -0.04 0.18 0.00 0.41 -0.57 0.00 0.00 179.45 179.43 1wfz n GLY 47 N -0.14 0.90 3.72 3.86 0.00 -0.60 -5.09 105.19 107.85 1wfz n GLY 47 Ca -0.01 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.34 3.25 -0.42 1.61 2.36 -1.26 -3.28 119.74 121.65 1wfz s LYS 48 Ca 0.00 -0.33 -0.28 0.00 -2.55 0.00 0.00 55.97 52.81 1wfz s LYS 48 Cb 0.00 -2.95 -0.02 0.00 -1.05 0.00 0.00 37.83 33.81 1wfz s LYS 48 CO 0.00 0.65 1.82 0.42 1.55 0.00 0.00 175.35 179.79 1wfz s ILE 49 N -0.72 3.45 -0.07 5.43 1.01 -0.23 -2.72 121.20 127.35 1wfz s ILE 49 Ca 0.12 0.41 0.04 0.00 0.00 0.00 0.00 60.65 61.22 1wfz s ILE 49 Cb -0.12 -3.74 -0.24 0.00 0.01 0.00 0.00 42.46 38.37 1wfz s ILE 49 CO 0.02 -0.56 0.55 1.33 0.00 0.00 0.00 174.94 176.29 1wfz n VAL 50 N 7.36 1.69 -4.45 2.92 0.24 -0.84 -1.70 118.33 123.55 1wfz n VAL 50 Ca 0.22 -0.74 -0.20 0.00 -2.04 0.00 0.00 64.34 61.58 1wfz n VAL 50 Cb 0.49 -1.33 -0.15 0.00 -1.47 0.00 0.00 33.84 31.38 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 -6.49 1.35 -0.01 -1.34 1.11 -1.23 -4.79 116.67 105.26 1wfz s ASP 51 Ca -0.12 -0.25 0.01 0.00 0.18 0.00 0.00 52.55 52.37 1wfz s ASP 51 Cb 0.07 -0.13 0.01 0.00 1.07 0.00 0.00 42.92 43.94 1wfz s ASP 51 CO 0.80 0.11 -0.02 0.00 1.18 0.00 0.00 175.17 177.25 1wfz s ALA 52 N -0.38 0.24 0.13 5.23 0.00 -1.26 -0.61 121.76 125.10 1wfz s ALA 52 Ca 0.03 -0.03 0.06 0.00 0.00 0.00 0.00 51.96 52.03 1wfz s ALA 52 Cb -0.05 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 1wfz s ALA 52 CO -0.00 0.02 -0.15 1.03 0.00 0.00 0.00 175.76 176.66 1wfz s ARG 53 N 0.24 1.06 -0.06 0.00 1.81 0.48 -4.82 118.95 117.66 1wfz s ARG 53 Ca -0.02 -1.26 -0.03 0.00 -1.72 0.00 0.00 55.73 52.70 1wfz s ARG 53 Cb -0.05 -0.98 0.04 0.00 -0.45 0.00 0.00 34.95 33.51 1wfz s ARG 53 CO -0.01 0.19 0.13 -0.59 -0.68 0.00 0.00 175.30 174.35 1wfz s PHE 54 N -2.09 -0.13 -0.28 -0.53 -0.12 -1.25 -2.57 117.98 111.01 1wfz s PHE 54 Ca 0.10 0.46 -0.03 0.00 -0.05 0.00 0.00 56.93 57.40 1wfz s PHE 54 Cb -0.05 -0.16 0.09 0.00 -0.63 0.00 0.00 43.02 42.27 1wfz s PHE 54 CO 0.04 -0.18 0.10 0.21 -0.05 0.00 0.00 175.22 175.34 1wfz s LYS 55 N 1.44 0.42 0.07 1.99 2.47 -0.77 -4.24 119.74 121.11 1wfz s LYS 55 Ca -0.06 -0.68 0.04 0.00 -1.56 0.00 0.00 55.97 53.72 1wfz s LYS 55 Cb -0.12 -1.62 -0.04 0.00 -1.46 0.00 0.00 37.83 34.60 1wfz s LYS 55 CO -0.05 -0.94 -0.01 0.99 0.16 0.00 0.00 175.35 175.50 1wfz s THR 56 N 1.90 4.01 -0.21 3.43 2.01 -1.25 -0.19 115.64 125.35 1wfz s THR 56 Ca 0.08 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.13 1wfz s THR 56 Cb -0.17 -2.88 0.07 0.00 0.01 0.00 0.00 72.50 69.53 1wfz s THR 56 CO -0.27 0.19 0.08 -0.36 -0.69 0.00 0.00 174.62 173.56 1wfz s PHE 57 N -1.25 0.64 0.00 4.92 0.08 -0.69 -4.92 117.98 116.76 1wfz s PHE 57 Ca 0.24 -0.71 0.00 0.00 0.12 0.00 0.00 56.93 56.58 1wfz s PHE 57 Cb -0.12 -0.92 0.00 0.00 -0.57 0.00 0.00 43.02 41.41 1wfz s PHE 57 CO 0.16 -0.62 0.00 0.41 -0.10 0.00 0.00 175.22 175.07 1wfz n GLY 58 N 5.16 0.26 3.28 4.36 0.00 -1.26 -1.63 105.19 115.36 1wfz n GLY 58 Ca -0.07 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 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 -3.43 0.00 -1.18 0.00 0.00 -2.00 -3.30 103.07 93.16 1wfz h GLY 60 Ca -0.47 0.00 0.38 0.00 0.00 0.00 0.00 47.33 47.25 1wfz h GLY 60 CO 0.31 0.00 0.79 -1.26 0.00 0.00 0.00 176.54 176.39 1wfz n SER 61 N -4.69 0.11 -0.03 0.19 2.88 -1.26 0.22 113.62 111.03 1wfz n SER 61 Ca -0.05 0.94 -0.13 0.00 -1.33 0.00 0.00 58.87 58.30 1wfz n SER 61 Cb 0.17 -0.46 -0.10 0.00 -0.75 0.00 0.00 64.21 63.07 1wfz n SER 61 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wfz h ALA 62 N 1.04 0.05 -0.69 -1.46 0.00 -1.92 -1.94 119.26 114.35 1wfz h ALA 62 Ca 0.67 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 55.20 1wfz h ALA 62 Cb 2.35 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 20.11 1wfz h ALA 62 CO -0.24 -0.12 0.16 0.82 0.00 0.00 0.00 179.25 179.87 1wfz h ILE 63 N -0.45 1.26 0.18 0.00 2.04 0.25 -2.53 117.51 118.26 1wfz h ILE 63 Ca 0.00 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 64.88 1wfz h ILE 63 Cb 0.65 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1wfz h ILE 63 CO 0.01 0.37 -0.09 0.00 0.00 0.00 0.00 178.15 178.45 1wfz h ALA 64 N 1.12 -0.82 -0.96 1.87 0.00 -0.97 -1.47 119.26 118.03 1wfz h ALA 64 Ca 0.22 -0.05 0.28 0.00 0.00 0.00 0.00 54.91 55.35 1wfz h ALA 64 Cb 0.38 0.10 -0.17 0.00 0.00 0.00 0.00 17.79 18.09 1wfz h ALA 64 CO 0.00 -0.80 0.12 0.77 0.00 0.00 0.00 179.25 179.34 1wfz h SER 65 N -0.30 -0.30 0.03 0.00 0.02 -1.42 0.36 113.55 111.92 1wfz h SER 65 Ca -0.03 0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1wfz h SER 65 Cb 0.19 0.42 0.00 0.00 0.14 0.00 0.00 62.40 63.15 1wfz h SER 65 CO 0.04 -0.33 -0.01 0.77 -1.14 0.00 0.00 176.83 176.16 1wfz h SER 66 N 0.04 -0.03 -0.98 3.07 4.64 -1.46 0.25 113.55 119.08 1wfz h SER 66 Ca 0.62 -0.07 0.18 0.00 -0.47 0.00 0.00 61.79 62.04 1wfz h SER 66 Cb 1.32 0.01 -0.09 0.00 -0.31 0.00 0.00 62.40 63.32 1wfz h SER 66 CO -0.85 0.05 0.61 0.77 -0.87 0.00 0.00 176.83 176.54 1wfz h SER 67 N -0.11 0.72 0.22 4.97 4.64 0.78 0.45 113.55 125.23 1wfz h SER 67 Ca -0.00 0.07 -0.30 0.00 -0.47 0.00 0.00 61.79 61.09 1wfz h SER 67 Cb 0.10 -0.06 0.03 0.00 -0.31 0.00 0.00 62.40 62.15 1wfz h SER 67 CO 0.01 0.30 -1.25 0.25 -0.87 0.00 0.00 176.83 175.26 1wfz h LEU 68 N 0.73 0.80 0.57 5.97 6.46 -0.90 -3.22 115.31 125.72 1wfz h LEU 68 Ca 0.53 -0.75 -0.03 0.00 -0.12 0.00 0.00 57.88 57.51 1wfz h LEU 68 Cb 0.87 -0.25 0.01 0.00 -0.73 0.00 0.00 40.66 40.56 1wfz h LEU 68 CO -0.30 1.56 -0.28 0.00 -0.62 0.00 0.00 178.44 178.80 1wfz h ALA 69 N 0.35 -0.88 -0.23 1.25 0.00 0.90 -1.95 119.26 118.70 1wfz h ALA 69 Ca -0.18 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.63 1wfz h ALA 69 Cb 1.93 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 20.01 1wfz h ALA 69 CO 0.23 -0.83 0.66 0.00 0.00 0.00 0.00 179.25 179.32 1wfz h THR 70 N -1.04 0.07 0.00 0.00 1.03 -0.33 1.23 112.91 113.87 1wfz h THR 70 Ca -0.08 0.00 -0.25 0.00 -0.01 0.00 0.00 66.41 66.07 1wfz h THR 70 Cb 0.59 0.39 -0.04 0.00 -1.07 0.00 0.00 68.15 68.02 1wfz h THR 70 CO 0.13 0.00 -1.46 -0.08 -0.01 0.00 0.00 175.52 174.10 1wfz h GLU 71 N 0.00 0.00 -0.31 0.00 4.81 -1.52 -3.31 114.58 114.25 1wfz h GLU 71 Ca 0.11 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.22 1wfz h GLU 71 Cb 1.43 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.81 1wfz h GLU 71 CO -0.00 0.57 -0.26 -1.49 -0.73 0.00 0.00 179.01 177.10 1wfz h TRP 72 N 0.00 0.86 -0.77 0.92 4.06 0.23 -3.16 115.95 118.09 1wfz h TRP 72 Ca -0.19 -0.25 0.01 0.00 2.06 0.00 0.00 58.89 60.52 1wfz h TRP 72 Cb 1.87 -0.19 -0.04 0.00 -1.00 0.00 0.00 29.16 29.81 1wfz h TRP 72 CO 0.00 0.99 0.51 -0.39 -3.56 0.00 0.00 178.44 175.99 1wfz h VAL 73 N 0.48 1.20 -1.36 1.49 -1.51 -1.56 -3.41 116.25 111.58 1wfz h VAL 73 Ca 0.05 -0.37 -0.71 0.00 -1.23 0.00 0.00 66.70 64.45 1wfz h VAL 73 Cb 0.83 0.06 0.07 0.00 -2.13 0.00 0.00 31.29 30.12 1wfz h VAL 73 CO 0.07 0.19 0.04 0.29 -1.23 0.00 0.00 177.57 176.93 1wfz n LYS 74 N -4.54 0.48 0.00 5.19 5.02 -1.19 -0.09 118.16 123.02 1wfz n LYS 74 Ca 0.08 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 1wfz n LYS 74 Cb 0.02 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 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 1.86 1.85 3.90 0.72 0.00 -0.69 -4.98 105.19 107.85 1wfz n GLY 75 Ca 0.18 -0.18 -0.29 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 2.20 0.32 1.61 1.02 0.87 -4.65 119.74 121.12 1wfz s LYS 76 Ca 0.00 0.17 0.03 0.00 0.02 0.00 0.00 55.97 56.19 1wfz s LYS 76 Cb 0.00 -1.99 -0.02 0.00 -0.52 0.00 0.00 37.83 35.30 1wfz s LYS 76 CO 0.00 -1.43 0.49 0.95 -0.92 0.00 0.00 175.35 174.44 1wfz s THR 77 N -3.50 4.80 0.33 2.17 -4.23 -1.26 -1.06 115.64 112.89 1wfz s THR 77 Ca 0.61 -0.74 0.10 0.00 -1.18 0.00 0.00 61.69 60.48 1wfz s THR 77 Cb -0.11 -3.72 0.32 0.00 1.34 0.00 0.00 72.50 70.33 1wfz s THR 77 CO 0.49 -0.38 1.75 -0.37 -0.54 0.00 0.00 174.62 175.58 1wfz h VAL 78 N 0.86 0.57 -0.38 2.29 -1.51 -1.93 0.73 116.25 116.88 1wfz h VAL 78 Ca -0.49 -0.20 -0.01 0.00 -1.23 0.00 0.00 66.70 64.76 1wfz h VAL 78 Cb 1.23 -0.06 -0.02 0.00 -2.13 0.00 0.00 31.29 30.31 1wfz h VAL 78 CO 0.59 0.11 0.19 -0.33 -1.23 0.00 0.00 177.57 176.89 1wfz h GLU 79 N 0.58 0.55 -0.07 5.19 5.08 -1.94 -2.49 114.58 121.49 1wfz h GLU 79 Ca 0.62 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.91 1wfz h GLU 79 Cb 1.21 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 1wfz h GLU 79 CO -0.42 0.49 0.02 0.93 -1.00 0.00 0.00 179.01 179.03 1wfz h GLU 80 N 0.48 0.05 -0.95 2.33 4.39 -1.27 -2.50 114.58 117.12 1wfz h GLU 80 Ca 0.13 -0.00 0.15 0.00 0.34 0.00 0.00 59.36 59.97 1wfz h GLU 80 Cb 0.12 -0.01 -0.09 0.00 -0.10 0.00 0.00 28.75 28.66 1wfz h GLU 80 CO -0.02 0.04 0.56 0.00 -1.16 0.00 0.00 179.01 178.43 1wfz h ALA 81 N 1.04 1.47 -0.16 3.43 0.00 -1.21 0.21 119.26 124.04 1wfz h ALA 81 Ca 0.03 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1wfz h ALA 81 Cb 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1wfz h ALA 81 CO -0.03 0.05 0.15 -0.07 0.00 0.00 0.00 179.25 179.35 1wfz h LEU 82 N 0.81 0.00 0.00 0.00 -0.00 -0.98 0.19 115.31 115.32 1wfz h LEU 82 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.38 1wfz h LEU 82 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.30 1wfz h LEU 82 CO -0.32 0.00 -0.03 0.71 -0.00 0.00 0.00 178.44 178.80 1wfz h THR 83 N 0.00 0.00 -2.34 0.22 1.35 -0.50 -3.45 112.91 108.19 1wfz h THR 83 Ca 0.08 -0.89 -0.55 0.00 -0.55 0.00 0.00 66.41 64.50 1wfz h THR 83 Cb 0.37 1.87 0.01 0.00 -1.73 0.00 0.00 68.15 68.68 1wfz h THR 83 CO -0.00 0.00 1.27 -0.63 -0.25 0.00 0.00 175.52 175.91 1wfz s ILE 84 N -3.19 3.12 0.33 6.82 1.01 0.66 -4.98 121.20 124.96 1wfz s ILE 84 Ca 0.08 0.14 0.06 0.00 0.00 0.00 0.00 60.65 60.92 1wfz s ILE 84 Cb 0.07 -3.11 -0.01 0.00 0.01 0.00 0.00 42.46 39.42 1wfz s ILE 84 CO 0.66 -0.03 0.47 -0.54 0.00 0.00 0.00 174.94 175.50 1wfz s LYS 85 N 4.86 3.18 0.04 2.79 1.02 -1.26 -4.91 119.74 125.47 1wfz s LYS 85 Ca 0.89 -0.91 -0.17 0.00 0.02 0.00 0.00 55.97 55.80 1wfz s LYS 85 Cb -0.38 -2.81 -0.23 0.00 -0.52 0.00 0.00 37.83 33.88 1wfz s LYS 85 CO 0.38 0.10 1.15 -2.95 -0.92 0.00 0.00 175.35 173.11 1wfz h ASN 86 N 0.90 0.75 -1.00 2.83 7.08 -1.93 -3.32 115.58 120.89 1wfz h ASN 86 Ca -0.47 -0.75 0.17 0.00 -3.08 0.00 0.00 56.30 52.17 1wfz h ASN 86 Cb 1.25 -0.23 -0.17 0.00 -2.08 0.00 0.00 38.32 37.09 1wfz h ASN 86 CO 0.55 1.40 -0.35 0.71 -2.08 0.00 0.00 177.43 177.66 1wfz h THR 87 N 0.17 0.00 -0.11 6.14 1.35 -1.96 0.14 112.91 118.64 1wfz h THR 87 Ca -0.11 0.00 0.04 0.00 -0.55 0.00 0.00 66.41 65.79 1wfz h THR 87 Cb 1.53 0.00 -0.06 0.00 -1.73 0.00 0.00 68.15 67.89 1wfz h THR 87 CO 0.17 0.00 -0.41 0.44 -0.25 0.00 0.00 175.52 175.47 1wfz h ASP 88 N -0.00 -1.27 0.24 5.36 3.32 -2.00 -1.85 116.42 120.23 1wfz h ASP 88 Ca 0.39 0.17 -0.00 0.00 0.02 0.00 0.00 57.03 57.60 1wfz h ASP 88 Cb 0.64 0.52 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 1wfz h ASP 88 CO -1.00 -0.42 -0.30 0.40 -1.72 0.00 0.00 179.24 176.20 1wfz h ILE 89 N -0.49 0.00 -0.81 0.35 2.04 -0.94 0.12 117.51 117.77 1wfz h ILE 89 Ca 0.07 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.08 1wfz h ILE 89 Cb 0.62 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.56 1wfz h ILE 89 CO -0.38 0.00 -0.25 0.00 0.00 0.00 0.00 178.15 177.52 1wfz n ALA 90 N -2.61 0.06 0.24 1.87 0.00 -0.22 -0.29 120.51 119.55 1wfz n ALA 90 Ca -0.07 0.85 -0.15 0.00 0.00 0.00 0.00 53.44 54.08 1wfz n ALA 90 Cb 0.26 -0.46 -0.08 0.00 0.00 0.00 0.00 19.45 19.18 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 -0.59 -0.91 0.00 3.64 -1.01 0.49 116.57 118.19 1wfz h LYS 91 Ca 0.34 0.04 0.12 0.00 -1.27 0.00 0.00 60.65 59.89 1wfz h LYS 91 Cb 0.54 0.13 -0.14 0.00 -0.41 0.00 0.00 32.23 32.36 1wfz h LYS 91 CO -0.82 -0.29 -0.44 1.49 -2.27 0.00 0.00 179.45 177.11 1wfz h GLU 92 N -0.85 -0.04 0.00 1.90 4.57 0.21 0.81 114.58 121.18 1wfz h GLU 92 Ca -0.06 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1wfz h GLU 92 Cb 0.57 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1wfz h GLU 92 CO 0.10 -0.03 0.00 -0.07 -1.18 0.00 0.00 179.01 177.83 1wfz h LEU 93 N -0.05 0.00 -1.41 1.64 4.07 -1.11 -3.47 115.31 114.98 1wfz h LEU 93 Ca 0.27 0.00 -0.38 0.00 0.08 0.00 0.00 57.88 57.85 1wfz h LEU 93 Cb 0.54 0.00 0.12 0.00 1.08 0.00 0.00 40.66 42.40 1wfz h LEU 93 CO -0.91 0.00 -0.76 0.00 -1.08 0.00 0.00 178.44 175.69 1wfz s LEU 95 N -6.77 3.65 1.02 0.00 0.05 -0.92 -5.02 118.68 110.68 1wfz s LEU 95 Ca 0.22 1.78 -0.13 0.00 0.05 0.00 0.00 54.13 56.05 1wfz s LEU 95 Cb -0.10 -4.53 0.20 0.00 -2.05 0.00 0.00 46.19 39.70 1wfz s LEU 95 CO 0.76 -0.88 1.09 -2.16 -0.55 0.00 0.00 176.35 174.62 1wfz s PRO 96 N -3.80 0.25 0.19 1.48 0.04 -1.26 -4.93 135.00 126.97 1wfz s PRO 96 Ca 0.63 0.46 0.21 0.00 0.04 0.00 0.00 61.00 62.35 1wfz s PRO 96 Cb -0.14 -1.72 0.88 0.00 0.04 0.00 0.00 34.50 33.56 1wfz s PRO 96 CO 0.30 -2.84 1.64 -0.35 0.04 0.00 0.00 177.00 175.79 1wfz n PRO 97 N -4.24 0.14 0.04 0.56 -0.04 -1.26 -2.51 135.00 127.69 1wfz n PRO 97 Ca 0.05 0.38 -0.09 0.00 -0.04 0.00 0.00 63.50 63.80 1wfz n PRO 97 Cb 0.57 -1.77 -0.13 0.00 -0.04 0.00 0.00 33.50 32.14 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 1.41 -0.91 0.52 3.04 -2.04 -3.29 116.25 114.97 1wfz h VAL 98 Ca 0.00 -3.14 -0.42 0.00 -1.01 0.00 0.00 66.70 62.13 1wfz h VAL 98 Cb 0.33 2.73 -0.25 0.00 -2.01 0.00 0.00 31.29 32.09 1wfz h VAL 98 CO 0.00 0.82 0.53 0.29 -1.01 0.00 0.00 177.57 178.20 1wfz n LYS 99 N -3.29 2.75 -0.06 4.17 4.76 -1.04 -4.52 118.16 120.93 1wfz n LYS 99 Ca -0.07 -3.02 -0.12 0.00 -2.87 0.00 0.00 58.31 52.23 1wfz n LYS 99 Cb 0.99 -2.19 -0.06 0.00 -1.84 0.00 0.00 35.03 31.93 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 1.57 0.31 -1.12 -0.35 3.38 -1.63 -3.01 115.31 114.46 1wfz h LEU 100 Ca 0.51 -0.34 0.41 0.00 0.09 0.00 0.00 57.88 58.56 1wfz h LEU 100 Cb 2.70 -0.08 -0.14 0.00 0.09 0.00 0.00 40.66 43.23 1wfz h LEU 100 CO 0.99 0.57 0.69 0.00 0.09 0.00 0.00 178.44 180.78 1wfz n HIS 101 N -4.70 0.77 0.27 1.13 1.44 -1.26 0.24 115.22 113.10 1wfz n HIS 101 Ca -0.05 0.78 -0.13 0.00 -2.01 0.00 0.00 57.72 56.30 1wfz n HIS 101 Cb 0.24 -1.20 -0.07 0.00 0.12 0.00 0.00 29.99 29.08 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 -5.28 -0.58 -0.01 0.00 3.41 0.14 0.20 113.62 111.49 1wfz n SER 103 Ca -0.10 1.29 -0.07 0.00 -0.26 0.00 0.00 58.87 59.73 1wfz n SER 103 Cb 0.32 -0.25 0.12 0.00 -0.26 0.00 0.00 64.21 64.13 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 0.57 -0.83 4.33 -0.00 -1.58 -3.08 114.93 114.35 1wfz h MET 104 Ca 0.21 -0.27 0.17 0.00 -0.00 0.00 0.00 59.70 59.80 1wfz h MET 104 Cb 0.39 -0.00 -0.10 0.00 -0.00 0.00 0.00 31.60 31.88 1wfz h MET 104 CO -0.72 0.85 0.38 1.25 -0.00 0.00 0.00 176.91 178.67 1wfz h LEU 105 N 0.48 0.39 -0.96 -0.10 5.85 0.33 0.90 115.31 122.21 1wfz h LEU 105 Ca 0.05 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 1wfz h LEU 105 Cb 0.85 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.91 1wfz h LEU 105 CO 0.07 0.12 0.58 0.00 -0.34 0.00 0.00 178.44 178.87 1wfz h ALA 106 N 1.60 1.22 0.42 1.25 0.00 -1.09 -1.50 119.26 121.15 1wfz h ALA 106 Ca 0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 1wfz h ALA 106 Cb 0.76 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1wfz h ALA 106 CO -0.42 0.67 -0.20 1.49 0.00 0.00 0.00 179.25 180.78 1wfz h GLU 107 N 1.32 -0.54 -0.79 0.00 4.81 -0.94 -2.45 114.58 115.98 1wfz h GLU 107 Ca 0.34 0.04 0.14 0.00 -0.13 0.00 0.00 59.36 59.75 1wfz h GLU 107 Cb -0.07 0.12 -0.09 0.00 0.63 0.00 0.00 28.75 29.34 1wfz h GLU 107 CO -0.07 -0.24 0.36 -0.44 -0.73 0.00 0.00 179.01 177.90 1wfz h ASP 108 N -0.83 0.40 -0.20 1.04 3.32 -1.11 -1.41 116.42 117.62 1wfz h ASP 108 Ca -0.06 0.10 0.03 0.00 0.02 0.00 0.00 57.03 57.12 1wfz h ASP 108 Cb 0.55 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 1wfz h ASP 108 CO 0.09 0.16 0.03 0.00 -1.72 0.00 0.00 179.24 177.81 1wfz h ALA 109 N 1.54 0.20 0.19 3.45 0.00 -1.22 -1.84 119.26 121.58 1wfz h ALA 109 Ca 0.43 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.38 1wfz h ALA 109 Cb 0.62 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1wfz h ALA 109 CO -0.38 -0.40 -0.29 0.82 0.00 0.00 0.00 179.25 179.00 1wfz h ILE 110 N 0.11 0.00 -0.59 0.00 2.04 -0.77 -2.12 117.51 116.18 1wfz h ILE 110 Ca 0.09 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.04 1wfz h ILE 110 Cb 0.09 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.06 1wfz h ILE 110 CO -0.13 0.00 -0.43 0.11 0.00 0.00 0.00 178.15 177.71 1wfz h LYS 111 N -0.51 -0.21 -0.85 2.37 6.56 -1.40 0.40 116.57 122.93 1wfz h LYS 111 Ca -0.02 0.01 0.19 0.00 -1.06 0.00 0.00 60.65 59.77 1wfz h LYS 111 Cb 0.47 0.05 -0.16 0.00 -0.57 0.00 0.00 32.23 32.02 1wfz h LYS 111 CO -0.09 -0.14 -0.09 0.00 -2.06 0.00 0.00 179.45 177.07 1wfz h ALA 112 N 0.66 0.76 -0.13 3.86 0.00 -1.15 0.95 119.26 124.20 1wfz h ALA 112 Ca 0.18 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1wfz h ALA 112 Cb 0.56 0.56 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1wfz h ALA 112 CO -0.69 -0.44 0.00 0.00 0.00 0.00 0.00 179.25 178.12 1wfz n ALA 113 N -3.19 -0.32 -0.12 0.00 0.00 0.11 -0.75 120.51 116.24 1wfz n ALA 113 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.49 1wfz n ALA 113 Cb 0.51 0.17 -0.05 0.00 0.00 0.00 0.00 19.45 20.08 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 -1.41 0.00 0.00 -0.00 -1.14 -1.90 115.31 110.87 1wfz h LEU 114 Ca 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 1wfz h LEU 114 Cb 0.00 0.61 0.00 0.00 -0.00 0.00 0.00 40.66 41.27 1wfz h LEU 114 CO 0.00 -0.37 0.00 0.00 -0.00 0.00 0.00 178.44 178.07 1wfz n ALA 115 N -3.05 -0.14 -0.31 1.53 0.00 0.28 -0.77 120.51 118.04 1wfz n ALA 115 Ca -0.01 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.55 1wfz n ALA 115 Cb 0.35 0.35 0.24 0.00 0.00 0.00 0.00 19.45 20.39 1wfz n ALA 115 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1wfz n ASP 116 N -2.65 -0.14 -0.03 0.00 -0.08 0.07 0.94 116.55 114.67 1wfz n ASP 116 Ca 0.00 1.54 -0.10 0.00 -1.51 0.00 0.00 54.79 54.71 1wfz n ASP 116 Cb 0.00 -0.54 -0.04 0.00 2.34 0.00 0.00 41.12 42.88 1wfz n ASP 116 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 1wfz h TYR 117 N 0.00 0.18 -0.57 -0.67 3.20 -0.40 -2.74 116.97 115.98 1wfz h TYR 117 Ca 0.53 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.40 1wfz h TYR 117 Cb 1.05 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 39.24 1wfz h TYR 117 CO -0.50 0.11 0.33 0.87 -1.64 0.00 0.00 178.16 177.33 1wfz h LYS 118 N 0.20 0.78 -0.99 1.82 1.57 0.27 -2.42 116.57 117.80 1wfz h LYS 118 Ca 0.06 -0.08 0.21 0.00 -1.87 0.00 0.00 60.65 58.98 1wfz h LYS 118 Cb -0.01 -0.16 -0.12 0.00 0.08 0.00 0.00 32.23 32.03 1wfz h LYS 118 CO -0.03 0.58 0.58 -0.07 -0.57 0.00 0.00 179.45 179.93 1wfz h LEU 119 N 0.76 0.69 -0.71 2.94 3.38 -0.46 0.47 115.31 122.38 1wfz h LEU 119 Ca 0.20 0.12 -0.13 0.00 0.09 0.00 0.00 57.88 58.16 1wfz h LEU 119 Cb 0.01 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1wfz h LEU 119 CO -0.04 0.17 -0.63 0.11 0.09 0.00 0.00 178.44 178.15 1wfz h LYS 120 N 0.65 0.00 0.00 1.13 1.57 -1.19 0.31 116.57 119.04 1wfz h LYS 120 Ca 0.60 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 59.23 1wfz h LYS 120 Cb 1.04 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 1wfz h LYS 120 CO -0.44 0.63 -0.74 1.96 -0.57 0.00 0.00 179.45 180.29 1wfz h GLN 121 N 0.00 0.00 0.07 3.15 1.08 0.17 -3.27 115.11 116.31 1wfz h GLN 121 Ca -0.01 0.00 -0.31 0.00 -1.45 0.00 0.00 58.65 56.89 1wfz h GLN 121 Cb 1.13 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.54 1wfz h GLN 121 CO 0.08 0.74 -1.68 1.05 -0.95 0.00 0.00 178.83 178.08 1wfz h GLU 122 N 0.00 0.14 0.00 1.46 4.11 -0.54 -3.50 114.58 116.25 1wfz h GLU 122 Ca -0.01 -0.24 0.15 0.00 0.07 0.00 0.00 59.36 59.33 1wfz h GLU 122 Cb 1.38 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.69 1wfz h GLU 122 CO 0.10 0.88 0.41 0.45 0.07 0.00 0.00 179.01 180.92 1wfz n SER 123 N -3.29 -0.70 -0.05 3.06 2.88 0.09 -5.06 113.62 110.55 1wfz n SER 123 Ca -0.19 -1.23 -0.22 0.00 -1.33 0.00 0.00 58.87 55.90 1wfz n SER 123 Cb 1.04 1.10 -0.13 0.00 -0.75 0.00 0.00 64.21 65.48 1wfz n SER 123 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1wfz n LYS 124 N -0.44 0.68 -1.66 -1.46 0.00 -1.26 -3.35 118.16 110.68 1wfz n LYS 124 Ca 0.01 0.33 -0.12 0.00 0.00 0.00 0.00 58.31 58.54 1wfz n LYS 124 Cb 0.30 -1.68 0.06 0.00 0.00 0.00 0.00 35.03 33.71 1wfz n LYS 124 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1wfz n SER 125 N -3.78 0.73 0.00 3.14 2.88 -1.26 -4.88 113.62 110.46 1wfz n SER 125 Ca -0.36 -1.60 0.00 0.00 -1.33 0.00 0.00 58.87 55.58 1wfz n SER 125 Cb 0.93 -0.32 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 1wfz n SER 125 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wfz n GLY 126 N 1.10 5.09 1.11 0.46 0.00 -1.26 -4.93 105.19 106.77 1wfz n GLY 126 Ca 0.08 -1.33 -0.09 0.00 0.00 0.00 0.00 46.02 44.68 1wfz n GLY 126 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wfz n PRO 127 N 0.00 -1.70 -3.19 1.61 -0.04 -1.26 -4.99 135.00 125.44 1wfz n PRO 127 Ca 0.00 -0.55 -0.41 0.00 -0.04 0.00 0.00 63.50 62.50 1wfz n PRO 127 Cb 0.00 -0.52 -0.07 0.00 -0.04 0.00 0.00 33.50 32.87 1wfz n PRO 127 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wfz s SER 128 N -2.44 6.40 -0.70 3.54 0.15 -1.26 -5.02 113.70 114.37 1wfz s SER 128 Ca 0.22 0.20 -0.23 0.00 0.70 0.00 0.00 55.95 56.84 1wfz s SER 128 Cb -0.02 -2.30 0.07 0.00 -1.71 0.00 0.00 66.02 62.06 1wfz s SER 128 CO 0.17 -0.47 1.03 -0.55 1.20 0.00 0.00 173.24 174.62 1wfz s SER 129 N 1.71 6.21 0.00 5.45 0.15 -1.26 -5.37 113.70 120.58 1wfz s SER 129 Ca 0.22 -0.99 0.00 0.00 0.70 0.00 0.00 55.95 55.88 1wfz s SER 129 Cb -0.15 -2.44 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1wfz s SER 129 CO 0.13 -1.48 0.00 0.61 1.20 0.00 0.00 173.24 173.70