#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wfz h SER 2 N 0.00 0.00 -2.84 1.61 4.64 -2.03 -3.43 113.55 111.50 1wfz h SER 2 Ca 0.00 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.68 1wfz h SER 2 Cb 0.00 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.03 1wfz h SER 2 CO 0.00 0.00 -0.38 -0.94 -0.87 0.00 0.00 176.83 174.64 1wfz s SER 3 N -4.80 6.53 0.00 4.97 1.04 -1.26 -5.01 113.70 115.18 1wfz s SER 3 Ca 0.05 0.62 0.00 0.00 0.48 0.00 0.00 55.95 57.09 1wfz s SER 3 Cb 0.09 -2.12 0.00 0.00 0.10 0.00 0.00 66.02 64.09 1wfz s SER 3 CO 0.48 0.32 0.00 0.61 0.98 0.00 0.00 173.24 175.63 1wfz n GLY 4 N 1.57 -1.40 3.29 7.32 0.00 -1.26 -4.95 105.19 109.76 1wfz n GLY 4 Ca -0.15 0.78 -0.34 0.00 0.00 0.00 0.00 46.02 46.31 1wfz n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wfz s SER 5 N 0.00 4.06 0.92 1.61 0.01 -1.26 -5.11 113.70 113.93 1wfz s SER 5 Ca 0.00 -0.42 -0.11 0.00 1.31 0.00 0.00 55.95 56.74 1wfz s SER 5 Cb 0.00 -1.67 0.15 0.00 0.21 0.00 0.00 66.02 64.70 1wfz s SER 5 CO 0.00 0.02 1.11 -0.44 0.41 0.00 0.00 173.24 174.35 1wfz s SER 6 N 1.21 3.02 0.00 2.44 0.01 -1.26 -5.00 113.70 114.12 1wfz s SER 6 Ca 0.02 1.95 0.00 0.00 1.31 0.00 0.00 55.95 59.24 1wfz s SER 6 Cb -0.14 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.60 1wfz s SER 6 CO -0.03 -3.00 0.00 0.61 0.41 0.00 0.00 173.24 171.23 1wfz n GLY 7 N -0.14 1.95 3.81 3.44 0.00 -1.26 -5.14 105.19 107.86 1wfz n GLY 7 Ca 0.10 0.09 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1wfz n GLY 7 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wfz s GLU 8 N 2.22 4.15 0.13 1.61 1.03 -1.26 -5.07 118.70 121.51 1wfz s GLU 8 Ca 0.00 0.66 -0.23 0.00 0.03 0.00 0.00 54.97 55.44 1wfz s GLU 8 Cb 0.00 -3.24 -0.07 0.00 -0.80 0.00 0.00 34.13 30.01 1wfz s GLU 8 CO 0.00 0.63 0.69 1.21 -1.33 0.00 0.00 175.26 176.45 1wfz s ASN 9 N -1.01 7.25 1.06 0.83 3.84 -1.26 -5.08 114.94 120.57 1wfz s ASN 9 Ca 0.28 1.48 -0.05 0.00 0.21 0.00 0.00 52.86 54.78 1wfz s ASN 9 Cb -0.19 -2.44 0.07 0.00 -0.55 0.00 0.00 41.25 38.15 1wfz s ASN 9 CO 0.18 0.24 0.26 -0.81 -2.79 0.00 0.00 177.10 174.18 1wfz n PRO 10 N 1.64 -1.54 0.04 0.43 -0.04 -1.26 -5.07 135.00 129.21 1wfz n PRO 10 Ca -0.08 -0.42 0.00 0.00 -0.04 0.00 0.00 63.50 62.96 1wfz n PRO 10 Cb 0.50 -0.40 0.00 0.00 -0.04 0.00 0.00 33.50 33.56 1wfz n PRO 10 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1wfz n ARG 11 N -2.32 0.00 -1.74 0.54 1.85 -1.26 -4.91 116.66 108.83 1wfz n ARG 11 Ca 0.04 0.00 -0.19 0.00 -1.00 0.00 0.00 57.85 56.70 1wfz n ARG 11 Cb 0.14 -0.30 -0.10 0.00 -1.05 0.00 0.00 32.46 31.16 1wfz n ARG 11 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 1wfz s ASN 12 N -5.56 3.86 -0.21 2.89 2.47 -1.26 -4.80 114.94 112.34 1wfz s ASN 12 Ca 0.00 -1.18 -0.04 0.00 0.42 0.00 0.00 52.86 52.06 1wfz s ASN 12 Cb 0.00 -2.60 0.07 0.00 -1.45 0.00 0.00 41.25 37.28 1wfz s ASN 12 CO 0.00 -4.32 0.09 -0.69 -3.72 0.00 0.00 177.10 168.46 1wfz s VAL 13 N 15.41 0.11 0.00 -5.21 1.01 -1.26 -4.34 120.40 126.12 1wfz s VAL 13 Ca 0.78 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.30 1wfz s VAL 13 Cb -0.04 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.51 1wfz s VAL 13 CO 0.17 -0.39 0.00 0.61 0.00 0.00 0.00 175.10 175.49 1wfz n GLY 14 N 5.20 4.49 3.64 4.51 0.00 -1.26 -5.05 105.19 116.72 1wfz n GLY 14 Ca -0.07 -1.00 -0.01 0.00 0.00 0.00 0.00 46.02 44.94 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 1.40 -1.13 0.48 1.61 1.04 -1.26 -4.72 113.70 111.12 1wfz s SER 15 Ca 0.00 1.57 -0.03 0.00 0.48 0.00 0.00 55.95 57.96 1wfz s SER 15 Cb 0.00 2.27 -0.02 0.00 0.10 0.00 0.00 66.02 68.38 1wfz s SER 15 CO 0.00 -0.22 0.75 -0.76 0.98 0.00 0.00 173.24 173.99 1wfz s LEU 16 N 2.87 3.59 0.03 2.42 1.43 -1.26 -5.00 118.68 122.76 1wfz s LEU 16 Ca -0.06 0.66 -0.30 0.00 -1.03 0.00 0.00 54.13 53.40 1wfz s LEU 16 Cb -0.12 -3.55 -0.09 0.00 0.03 0.00 0.00 46.19 42.46 1wfz s LEU 16 CO -0.19 -0.69 1.94 -0.62 0.23 0.00 0.00 176.35 177.02 1wfz s ASP 17 N -4.17 6.47 0.00 2.29 -1.08 -1.26 -4.85 116.67 114.07 1wfz s ASP 17 Ca 0.48 2.63 0.25 0.00 -0.52 0.00 0.00 52.55 55.40 1wfz s ASP 17 Cb -0.10 -2.53 0.91 0.00 -1.46 0.00 0.00 42.92 39.74 1wfz s ASP 17 CO 0.42 -1.04 1.66 2.29 0.52 0.00 0.00 175.17 179.02 1wfz n LYS 18 N 7.47 1.72 -0.01 4.34 -0.00 -1.26 -3.99 118.16 126.42 1wfz n LYS 18 Ca 0.20 -1.06 -0.21 0.00 -0.00 0.00 0.00 58.31 57.23 1wfz n LYS 18 Cb 0.41 -1.45 -0.13 0.00 -0.00 0.00 0.00 35.03 33.86 1wfz n LYS 18 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1wfz n THR 19 N 0.28 1.74 -0.40 0.58 -2.24 -1.26 -4.95 114.28 108.02 1wfz n THR 19 Ca 0.18 -0.56 -0.29 0.00 -2.27 0.00 0.00 64.05 61.11 1wfz n THR 19 Cb 0.36 -1.78 0.26 0.00 -2.10 0.00 0.00 70.33 67.07 1wfz n THR 19 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1wfz n SER 20 N -3.63 -2.77 -0.09 3.42 2.88 -1.26 -5.00 113.62 107.18 1wfz n SER 20 Ca -0.33 -0.43 -0.16 0.00 -1.33 0.00 0.00 58.87 56.62 1wfz n SER 20 Cb 0.99 -1.11 -0.07 0.00 -0.75 0.00 0.00 64.21 63.26 1wfz n SER 20 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1wfz n LYS 21 N -4.86 0.42 -0.38 -1.46 2.85 -1.26 -4.52 118.16 108.94 1wfz n LYS 21 Ca 0.06 0.14 0.32 0.00 -1.05 0.00 0.00 58.31 57.78 1wfz n LYS 21 Cb 0.56 -1.25 0.64 0.00 -0.65 0.00 0.00 35.03 34.33 1wfz n LYS 21 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 177.40 174.40 1wfz h ASN 22 N -0.35 0.22 -3.77 -5.58 7.08 -1.91 -3.36 115.58 107.91 1wfz h ASN 22 Ca -0.44 0.06 -0.63 0.00 -3.08 0.00 0.00 56.30 52.22 1wfz h ASN 22 Cb 1.51 0.03 -0.16 0.00 -2.08 0.00 0.00 38.32 37.62 1wfz h ASN 22 CO -0.18 -0.01 -0.48 0.54 -2.08 0.00 0.00 177.43 175.22 1wfz s VAL 23 N -5.22 5.31 0.40 6.14 0.11 -1.26 -0.81 120.40 125.07 1wfz s VAL 23 Ca -0.07 0.22 -0.04 0.00 -2.93 0.00 0.00 61.98 59.16 1wfz s VAL 23 Cb 0.26 -3.54 -0.04 0.00 -1.53 0.00 0.00 36.38 31.53 1wfz s VAL 23 CO 0.81 0.27 0.67 -0.83 -3.33 0.00 0.00 175.10 172.70 1wfz s GLY 24 N 1.49 1.58 -0.10 6.54 0.00 -0.25 -4.81 107.32 111.77 1wfz s GLY 24 Ca 0.08 -0.59 0.03 0.00 0.00 0.00 0.00 44.72 44.23 1wfz s GLY 24 CO 0.09 -0.47 -0.17 -1.59 0.00 0.00 0.00 173.10 170.96 1wfz s THR 25 N -2.45 1.58 -0.20 0.90 2.01 -1.26 -2.72 115.64 113.51 1wfz s THR 25 Ca 0.45 -0.72 -0.02 0.00 0.31 0.00 0.00 61.69 61.71 1wfz s THR 25 Cb -0.10 -1.41 0.06 0.00 0.01 0.00 0.00 72.50 71.05 1wfz s THR 25 CO 0.38 0.46 0.01 -0.83 -0.69 0.00 0.00 174.62 173.94 1wfz s GLY 26 N 0.71 0.85 -0.17 4.40 0.00 -0.41 -4.33 107.32 108.36 1wfz s GLY 26 Ca -0.12 -0.83 -0.01 0.00 0.00 0.00 0.00 44.72 43.76 1wfz s GLY 26 CO 0.03 1.27 -0.12 -2.27 0.00 0.00 0.00 173.10 172.00 1wfz s LEU 27 N 1.74 2.59 -0.17 0.66 2.96 -1.26 -0.04 118.68 125.17 1wfz s LEU 27 Ca -0.02 -0.45 -0.04 0.00 -0.22 0.00 0.00 54.13 53.40 1wfz s LEU 27 Cb -0.17 -1.61 0.07 0.00 0.50 0.00 0.00 46.19 44.98 1wfz s LEU 27 CO -0.07 0.05 0.17 0.68 -1.32 0.00 0.00 176.35 175.86 1wfz s VAL 28 N 1.01 -0.25 0.49 1.68 -7.23 -0.34 -4.98 120.40 110.79 1wfz s VAL 28 Ca -0.01 -0.02 0.06 0.00 -1.81 0.00 0.00 61.98 60.19 1wfz s VAL 28 Cb -0.15 -0.56 0.00 0.00 0.56 0.00 0.00 36.38 36.24 1wfz s VAL 28 CO -0.02 -0.14 0.30 -0.83 -0.31 0.00 0.00 175.10 174.09 1wfz s GLY 29 N 2.27 2.42 -0.14 2.32 0.00 -1.26 -2.80 107.32 110.13 1wfz s GLY 29 Ca 0.05 -1.42 -0.05 0.00 0.00 0.00 0.00 44.72 43.29 1wfz s GLY 29 CO -0.10 -1.94 0.05 0.00 0.00 0.00 0.00 173.10 171.12 1wfz s ALA 30 N -2.71 3.44 -0.02 3.20 0.00 -0.81 -4.87 121.76 120.00 1wfz s ALA 30 Ca 0.34 -0.75 -0.26 0.00 0.00 0.00 0.00 51.96 51.30 1wfz s ALA 30 Cb -0.00 -1.77 -0.20 0.00 0.00 0.00 0.00 23.12 21.14 1wfz s ALA 30 CO 0.20 0.40 1.27 -1.00 0.00 0.00 0.00 175.76 176.63 1wfz h PRO 31 N 5.87 0.01 0.07 0.00 0.13 -1.96 -0.22 132.00 135.89 1wfz h PRO 31 Ca -0.45 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1wfz h PRO 31 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1wfz h PRO 31 CO 0.63 0.49 -0.03 0.00 -0.23 0.00 0.00 178.00 178.86 1wfz h ALA 32 N 0.52 -0.42 -0.80 -0.56 0.00 -2.00 -3.32 119.26 112.67 1wfz h ALA 32 Ca 0.00 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.02 1wfz h ALA 32 Cb 0.49 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1wfz h ALA 32 CO 0.00 -0.42 0.53 0.00 0.00 0.00 0.00 179.25 179.36 1wfz n GLY 34 N -1.47 0.49 3.70 0.00 0.00 -0.11 -4.88 105.19 102.92 1wfz n GLY 34 Ca 0.15 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.09 4.68 -0.32 1.61 1.01 -1.08 -4.72 116.67 114.75 1wfz s ASP 35 Ca 0.08 -0.69 -0.01 0.00 0.71 0.00 0.00 52.55 52.64 1wfz s ASP 35 Cb -0.01 -0.82 0.11 0.00 1.01 0.00 0.00 42.92 43.21 1wfz s ASP 35 CO 0.15 -0.16 0.13 -0.69 0.21 0.00 0.00 175.17 174.80 1wfz s VAL 36 N -2.37 0.56 -0.47 -1.27 1.01 -0.70 -1.92 120.40 115.25 1wfz s VAL 36 Ca 0.35 -1.33 -0.17 0.00 0.00 0.00 0.00 61.98 60.83 1wfz s VAL 36 Cb -0.04 -1.43 0.05 0.00 0.00 0.00 0.00 36.38 34.96 1wfz s VAL 36 CO 0.22 -0.74 0.47 -0.32 0.00 0.00 0.00 175.10 174.73 1wfz s MET 37 N 1.61 3.05 -0.45 2.72 1.75 -1.12 -2.05 119.30 124.80 1wfz s MET 37 Ca 0.11 -1.05 -0.12 0.00 -1.25 0.00 0.00 55.69 53.38 1wfz s MET 37 Cb -0.18 -4.08 0.09 0.00 2.84 0.00 0.00 34.83 33.50 1wfz s MET 37 CO -0.24 -1.04 0.34 0.21 -0.65 0.00 0.00 175.02 173.64 1wfz s LYS 38 N 2.07 2.74 0.02 4.11 2.47 0.21 -1.20 119.74 130.16 1wfz s LYS 38 Ca 0.09 -1.49 -0.04 0.00 -1.56 0.00 0.00 55.97 52.97 1wfz s LYS 38 Cb -0.21 -3.96 -0.04 0.00 -1.46 0.00 0.00 37.83 32.16 1wfz s LYS 38 CO 0.10 -1.04 0.24 -1.17 0.16 0.00 0.00 175.35 173.63 1wfz s LEU 39 N 1.50 4.36 -0.15 5.43 2.96 0.95 -2.04 118.68 131.69 1wfz s LEU 39 Ca 0.04 0.45 -0.06 0.00 -0.22 0.00 0.00 54.13 54.34 1wfz s LEU 39 Cb -0.24 -2.73 0.07 0.00 0.50 0.00 0.00 46.19 43.78 1wfz s LEU 39 CO 0.03 0.23 0.32 -1.10 -1.32 0.00 0.00 176.35 174.51 1wfz s GLN 40 N -1.98 0.22 -0.05 1.98 -1.52 -0.93 -1.29 119.66 116.10 1wfz s GLN 40 Ca 0.29 0.82 0.03 0.00 -1.95 0.00 0.00 55.36 54.55 1wfz s GLN 40 Cb -0.13 0.07 0.01 0.00 -0.22 0.00 0.00 33.01 32.74 1wfz s GLN 40 CO 0.19 -0.25 -0.14 0.96 -0.25 0.00 0.00 175.29 175.80 1wfz s ILE 41 N 2.28 1.22 -0.41 1.08 -5.25 -1.10 -0.35 121.20 118.66 1wfz s ILE 41 Ca -0.02 -0.56 -0.17 0.00 -0.99 0.00 0.00 60.65 58.92 1wfz s ILE 41 Cb -0.12 -1.08 0.02 0.00 2.95 0.00 0.00 42.46 44.23 1wfz s ILE 41 CO -0.10 0.37 0.44 -1.58 -1.79 0.00 0.00 174.94 172.27 1wfz s GLN 42 N 0.40 3.19 0.03 0.37 0.74 0.84 -1.08 119.66 124.15 1wfz s GLN 42 Ca -0.10 -0.67 -0.18 0.00 0.05 0.00 0.00 55.36 54.45 1wfz s GLN 42 Cb -0.14 -3.94 -0.06 0.00 1.10 0.00 0.00 33.01 29.97 1wfz s GLN 42 CO 0.03 -0.81 0.52 0.08 -0.55 0.00 0.00 175.29 174.56 1wfz s VAL 43 N 2.16 4.88 0.37 1.34 1.01 0.01 -1.85 120.40 128.32 1wfz s VAL 43 Ca 0.13 1.09 0.01 0.00 0.00 0.00 0.00 61.98 63.21 1wfz s VAL 43 Cb -0.17 -3.84 0.07 0.00 0.00 0.00 0.00 36.38 32.44 1wfz s VAL 43 CO 0.14 0.53 0.51 -0.90 0.00 0.00 0.00 175.10 175.37 1wfz n ASP 44 N 2.03 0.75 -0.09 3.32 5.75 -1.06 -4.54 116.55 122.72 1wfz n ASP 44 Ca -0.11 -1.62 0.01 0.00 -0.01 0.00 0.00 54.79 53.06 1wfz n ASP 44 Cb 0.51 -0.32 0.30 0.00 -1.03 0.00 0.00 41.12 40.58 1wfz n ASP 44 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 1wfz h GLU 45 N 0.00 0.72 0.00 0.11 4.11 -1.98 -1.31 114.58 116.23 1wfz h GLU 45 Ca -0.17 -0.09 -0.03 0.00 0.07 0.00 0.00 59.36 59.14 1wfz h GLU 45 Cb 0.64 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 1wfz h GLU 45 CO 0.19 0.57 -0.14 0.87 0.07 0.00 0.00 179.01 180.57 1wfz h LYS 46 N 0.72 0.00 0.00 1.06 1.57 -2.03 -3.46 116.57 114.42 1wfz h LYS 46 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1wfz h LYS 46 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1wfz h LYS 46 CO -0.02 0.14 0.00 0.41 -0.57 0.00 0.00 179.45 179.40 1wfz n GLY 47 N 0.03 1.19 3.52 3.86 0.00 -0.49 -5.09 105.19 108.20 1wfz n GLY 47 Ca 0.00 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.29 2.58 -0.22 1.61 2.36 -1.26 -3.34 119.74 120.17 1wfz s LYS 48 Ca 0.00 -0.65 -0.29 0.00 -2.55 0.00 0.00 55.97 52.48 1wfz s LYS 48 Cb 0.00 -2.45 -0.02 0.00 -1.05 0.00 0.00 37.83 34.31 1wfz s LYS 48 CO 0.00 0.64 1.56 0.42 1.55 0.00 0.00 175.35 179.52 1wfz s ILE 49 N -0.77 3.77 -0.20 5.43 1.01 -0.63 -2.57 121.20 127.24 1wfz s ILE 49 Ca 0.12 0.88 0.17 0.00 0.00 0.00 0.00 60.65 61.82 1wfz s ILE 49 Cb -0.11 -3.76 -0.24 0.00 0.01 0.00 0.00 42.46 38.36 1wfz s ILE 49 CO 0.01 -0.29 0.06 1.33 0.00 0.00 0.00 174.94 176.05 1wfz n VAL 50 N 6.26 1.38 -4.16 2.92 0.24 -0.77 -2.23 118.33 121.98 1wfz n VAL 50 Ca 0.18 -0.84 -0.19 0.00 -2.04 0.00 0.00 64.34 61.45 1wfz n VAL 50 Cb 0.45 -0.50 -0.16 0.00 -1.47 0.00 0.00 33.84 32.16 1wfz n VAL 50 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1wfz s ASP 51 N -5.51 0.84 -0.02 -1.34 1.01 -1.24 -4.85 116.67 105.56 1wfz s ASP 51 Ca -0.11 -0.12 0.01 0.00 0.71 0.00 0.00 52.55 53.05 1wfz s ASP 51 Cb 0.06 -0.36 0.01 0.00 1.01 0.00 0.00 42.92 43.64 1wfz s ASP 51 CO 0.81 -0.03 -0.04 0.00 0.21 0.00 0.00 175.17 176.12 1wfz s ALA 52 N 0.72 0.49 0.04 5.23 0.00 -1.26 -0.11 121.76 126.87 1wfz s ALA 52 Ca -0.09 -0.06 0.07 0.00 0.00 0.00 0.00 51.96 51.88 1wfz s ALA 52 Cb -0.12 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 1wfz s ALA 52 CO 0.00 0.02 -0.19 1.03 0.00 0.00 0.00 175.76 176.63 1wfz s ARG 53 N 0.54 1.27 -0.10 0.00 1.81 0.52 -4.96 118.95 118.04 1wfz s ARG 53 Ca -0.06 -0.88 0.00 0.00 -1.72 0.00 0.00 55.73 53.07 1wfz s ARG 53 Cb -0.10 -1.35 0.02 0.00 -0.45 0.00 0.00 34.95 33.07 1wfz s ARG 53 CO -0.00 0.34 -0.08 -0.59 -0.68 0.00 0.00 175.30 174.29 1wfz s PHE 54 N -0.79 1.36 -0.32 -0.53 -0.12 -1.26 -2.18 117.98 114.15 1wfz s PHE 54 Ca 0.06 -0.62 0.00 0.00 -0.05 0.00 0.00 56.93 56.32 1wfz s PHE 54 Cb -0.08 -1.13 0.10 0.00 -0.63 0.00 0.00 43.02 41.28 1wfz s PHE 54 CO 0.02 -0.43 0.09 0.21 -0.05 0.00 0.00 175.22 175.05 1wfz s LYS 55 N 1.49 0.89 0.05 1.99 2.47 -0.86 -4.62 119.74 121.15 1wfz s LYS 55 Ca 0.00 -1.25 0.01 0.00 -1.56 0.00 0.00 55.97 53.17 1wfz s LYS 55 Cb -0.13 -2.27 -0.04 0.00 -1.46 0.00 0.00 37.83 33.93 1wfz s LYS 55 CO -0.05 -0.97 0.10 0.99 0.16 0.00 0.00 175.35 175.58 1wfz s THR 56 N 1.45 4.74 -0.20 3.43 2.01 -1.26 -0.62 115.64 125.20 1wfz s THR 56 Ca 0.10 -0.58 -0.04 0.00 0.31 0.00 0.00 61.69 61.48 1wfz s THR 56 Cb -0.18 -3.25 0.07 0.00 0.01 0.00 0.00 72.50 69.15 1wfz s THR 56 CO -0.21 0.21 0.09 -0.36 -0.69 0.00 0.00 174.62 173.66 1wfz s PHE 57 N -1.34 0.39 0.00 4.92 0.08 -0.87 -4.91 117.98 116.25 1wfz s PHE 57 Ca 0.28 -0.55 0.00 0.00 0.12 0.00 0.00 56.93 56.78 1wfz s PHE 57 Cb -0.12 -0.82 0.00 0.00 -0.57 0.00 0.00 43.02 41.51 1wfz s PHE 57 CO 0.20 -0.60 0.00 0.41 -0.10 0.00 0.00 175.22 175.13 1wfz n GLY 58 N 5.22 0.25 1.72 4.36 0.00 -1.26 -1.72 105.19 113.76 1wfz n GLY 58 Ca -0.07 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 44.97 1wfz n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wfz n GLY 60 N -2.85 -0.95 0.52 0.00 0.00 -1.26 -3.84 105.19 96.81 1wfz n GLY 60 Ca 0.07 -0.16 0.39 0.00 0.00 0.00 0.00 46.02 46.33 1wfz n GLY 60 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wfz n SER 61 N -4.61 0.03 -0.02 1.61 2.88 -1.26 0.17 113.62 112.43 1wfz n SER 61 Ca -0.08 0.84 -0.12 0.00 -1.33 0.00 0.00 58.87 58.17 1wfz n SER 61 Cb 0.28 -0.42 -0.10 0.00 -0.75 0.00 0.00 64.21 63.23 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 0.87 -0.06 -0.83 -1.46 0.00 -1.93 -1.20 119.26 114.65 1wfz h ALA 62 Ca 0.72 -0.32 0.07 0.00 0.00 0.00 0.00 54.91 55.38 1wfz h ALA 62 Cb 2.79 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 20.54 1wfz h ALA 62 CO -0.08 -0.17 0.51 0.82 0.00 0.00 0.00 179.25 180.32 1wfz h ILE 63 N -0.78 1.01 0.21 0.00 2.04 0.16 -2.15 117.51 118.01 1wfz h ILE 63 Ca -0.01 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1wfz h ILE 63 Cb 0.66 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1wfz h ILE 63 CO 0.01 0.17 -0.10 0.00 0.00 0.00 0.00 178.15 178.23 1wfz h ALA 64 N 1.41 -0.52 -0.84 1.87 0.00 -1.33 -2.48 119.26 117.37 1wfz h ALA 64 Ca 0.37 -0.06 0.34 0.00 0.00 0.00 0.00 54.91 55.56 1wfz h ALA 64 Cb 0.20 0.11 -0.15 0.00 0.00 0.00 0.00 17.79 17.95 1wfz h ALA 64 CO -0.19 -0.50 0.42 0.43 0.00 0.00 0.00 179.25 179.41 1wfz n SER 65 N -3.48 0.26 0.19 0.00 7.64 -0.45 0.27 113.62 118.05 1wfz n SER 65 Ca -0.04 1.40 -0.12 0.00 1.01 0.00 0.00 58.87 61.12 1wfz n SER 65 Cb 0.11 -0.67 -0.07 0.00 -1.01 0.00 0.00 64.21 62.58 1wfz n SER 65 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1wfz h SER 66 N 0.00 -0.45 -0.94 6.43 0.02 -1.43 -1.40 113.55 115.78 1wfz h SER 66 Ca 0.70 -0.12 0.25 0.00 -0.84 0.00 0.00 61.79 61.78 1wfz h SER 66 Cb 1.82 0.12 -0.13 0.00 0.14 0.00 0.00 62.40 64.34 1wfz h SER 66 CO -0.66 -0.03 0.45 -1.28 -1.14 0.00 0.00 176.83 174.17 1wfz h SER 67 N -0.98 0.39 0.09 3.07 0.87 0.30 0.67 113.55 117.96 1wfz h SER 67 Ca -0.05 0.17 -0.17 0.00 -1.23 0.00 0.00 61.79 60.51 1wfz h SER 67 Cb 0.54 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 1wfz h SER 67 CO 0.09 -0.04 -0.60 0.25 -0.53 0.00 0.00 176.83 176.00 1wfz h LEU 68 N 0.38 0.57 0.27 2.23 6.46 -1.16 -3.07 115.31 121.00 1wfz h LEU 68 Ca 0.62 -0.32 -0.01 0.00 -0.12 0.00 0.00 57.88 58.04 1wfz h LEU 68 Cb 1.26 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 41.02 1wfz h LEU 68 CO -0.56 1.04 -0.13 0.00 -0.62 0.00 0.00 178.44 178.17 1wfz h ALA 69 N 0.97 -0.46 0.00 1.25 0.00 0.99 -2.77 119.26 119.24 1wfz h ALA 69 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1wfz h ALA 69 Cb 1.14 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1wfz h ALA 69 CO 0.11 -0.43 0.67 0.00 0.00 0.00 0.00 179.25 179.60 1wfz h THR 70 N -0.83 0.00 0.05 0.00 1.03 -0.05 1.32 112.91 114.43 1wfz h THR 70 Ca -0.04 0.00 -0.29 0.00 -0.01 0.00 0.00 66.41 66.07 1wfz h THR 70 Cb 0.28 0.31 -0.03 0.00 -1.07 0.00 0.00 68.15 67.64 1wfz h THR 70 CO 0.06 0.00 -1.58 -0.08 -0.01 0.00 0.00 175.52 173.91 1wfz h GLU 71 N 0.00 0.11 -0.57 0.00 4.81 -1.52 -3.31 114.58 114.10 1wfz h GLU 71 Ca 0.00 -0.19 -0.11 0.00 -0.13 0.00 0.00 59.36 58.93 1wfz h GLU 71 Cb 1.34 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.78 1wfz h GLU 71 CO 0.00 0.86 -0.07 -1.49 -0.73 0.00 0.00 179.01 177.58 1wfz h TRP 72 N 0.03 1.17 -0.10 0.92 6.55 0.20 -2.79 115.95 121.93 1wfz h TRP 72 Ca -0.25 -0.23 -0.04 0.00 0.95 0.00 0.00 58.89 59.32 1wfz h TRP 72 Cb 1.98 -0.29 -0.01 0.00 -0.86 0.00 0.00 29.16 29.98 1wfz h TRP 72 CO 0.03 1.06 -0.12 -0.39 -1.05 0.00 0.00 178.44 177.97 1wfz h VAL 73 N 0.94 1.14 -2.16 1.49 -1.51 -1.59 -3.40 116.25 111.17 1wfz h VAL 73 Ca 0.15 -0.63 -0.60 0.00 -1.23 0.00 0.00 66.70 64.39 1wfz h VAL 73 Cb 0.64 1.20 0.06 0.00 -2.13 0.00 0.00 31.29 31.06 1wfz h VAL 73 CO 0.04 0.19 0.74 0.29 -1.23 0.00 0.00 177.57 177.60 1wfz n LYS 74 N -4.32 1.97 0.00 5.19 5.02 -1.05 -0.87 118.16 124.08 1wfz n LYS 74 Ca -0.01 0.71 0.00 0.00 -2.02 0.00 0.00 58.31 56.99 1wfz n LYS 74 Cb 0.23 -2.45 0.00 0.00 -0.02 0.00 0.00 35.03 32.79 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 3.25 2.63 3.91 0.72 0.00 -0.95 -4.98 105.19 109.77 1wfz n GLY 75 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.01 2.91 0.12 1.61 1.02 -0.05 -4.74 119.74 120.59 1wfz s LYS 76 Ca 0.00 0.15 -0.02 0.00 0.02 0.00 0.00 55.97 56.12 1wfz s LYS 76 Cb 0.00 -2.19 -0.05 0.00 -0.52 0.00 0.00 37.83 35.07 1wfz s LYS 76 CO 0.00 -0.80 0.31 0.95 -0.92 0.00 0.00 175.35 174.89 1wfz s THR 77 N -3.11 5.26 0.31 2.17 -4.23 -1.26 -1.60 115.64 113.18 1wfz s THR 77 Ca 0.55 -0.23 0.03 0.00 -1.18 0.00 0.00 61.69 60.86 1wfz s THR 77 Cb -0.11 -3.65 0.41 0.00 1.34 0.00 0.00 72.50 70.49 1wfz s THR 77 CO 0.47 0.03 1.53 1.33 -0.54 0.00 0.00 174.62 177.44 1wfz n VAL 78 N -0.01 -0.41 -0.16 2.29 0.24 -1.21 0.77 118.33 119.84 1wfz n VAL 78 Ca -0.04 2.14 -0.02 0.00 -2.04 0.00 0.00 64.34 64.38 1wfz n VAL 78 Cb 0.52 -3.15 0.06 0.00 -1.47 0.00 0.00 33.84 29.80 1wfz n VAL 78 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1wfz h GLU 79 N 0.00 0.16 0.33 7.34 5.08 -1.94 -1.69 114.58 123.86 1wfz h GLU 79 Ca 0.61 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.94 1wfz h GLU 79 Cb 1.29 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1wfz h GLU 79 CO -0.91 0.10 -0.16 0.93 -1.00 0.00 0.00 179.01 177.98 1wfz h GLU 80 N 0.16 -0.43 -0.93 2.33 4.39 -0.02 -2.75 114.58 117.34 1wfz h GLU 80 Ca 0.25 0.03 0.24 0.00 0.34 0.00 0.00 59.36 60.22 1wfz h GLU 80 Cb 0.36 0.10 -0.13 0.00 -0.10 0.00 0.00 28.75 28.98 1wfz h GLU 80 CO -0.38 -0.26 0.43 0.00 -1.16 0.00 0.00 179.01 177.64 1wfz h ALA 81 N 0.20 1.54 -0.58 3.43 0.00 -0.88 0.59 119.26 123.56 1wfz h ALA 81 Ca -0.05 0.17 0.12 0.00 0.00 0.00 0.00 54.91 55.15 1wfz h ALA 81 Cb 0.36 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1wfz h ALA 81 CO 0.07 -0.37 0.40 -0.07 0.00 0.00 0.00 179.25 179.28 1wfz h LEU 82 N 0.40 0.24 -0.50 0.00 -0.00 -1.01 0.08 115.31 114.51 1wfz h LEU 82 Ca 0.60 0.01 -0.17 0.00 -0.00 0.00 0.00 57.88 58.32 1wfz h LEU 82 Cb 1.17 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 41.78 1wfz h LEU 82 CO -0.54 0.14 -0.70 0.71 -0.00 0.00 0.00 178.44 178.04 1wfz h THR 83 N 0.26 1.41 -1.68 0.22 1.35 0.22 -3.45 112.91 111.25 1wfz h THR 83 Ca 0.27 -2.18 -0.70 0.00 -0.55 0.00 0.00 66.41 63.25 1wfz h THR 83 Cb 0.73 2.15 0.02 0.00 -1.73 0.00 0.00 68.15 69.31 1wfz h THR 83 CO -0.06 0.64 0.97 -0.38 -0.25 0.00 0.00 175.52 176.44 1wfz n ILE 84 N -3.81 0.39 -3.15 6.82 5.41 0.01 -4.96 119.36 120.08 1wfz n ILE 84 Ca -0.03 -0.07 -0.17 0.00 1.00 0.00 0.00 62.75 63.48 1wfz n ILE 84 Cb 0.69 -1.42 0.05 0.00 -0.71 0.00 0.00 39.64 38.25 1wfz n ILE 84 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1wfz n LYS 85 N 5.78 0.68 -0.02 0.38 4.01 -1.26 -4.92 118.16 122.81 1wfz n LYS 85 Ca 0.25 -2.69 -0.21 0.00 -0.51 0.00 0.00 58.31 55.16 1wfz n LYS 85 Cb 0.18 -0.13 -0.13 0.00 -0.51 0.00 0.00 35.03 34.43 1wfz n LYS 85 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1wfz n ASN 86 N -2.35 2.09 -0.33 4.39 0.23 -1.26 -4.31 115.26 113.72 1wfz n ASN 86 Ca 0.12 0.17 0.06 0.00 -0.53 0.00 0.00 54.58 54.40 1wfz n ASN 86 Cb 0.51 -0.81 0.15 0.00 -2.08 0.00 0.00 39.78 37.55 1wfz n ASN 86 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 1wfz h THR 87 N -0.01 0.08 -0.28 5.53 1.35 -1.97 0.33 112.91 117.94 1wfz h THR 87 Ca -0.45 -0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.47 1wfz h THR 87 Cb 1.97 0.07 -0.06 0.00 -1.73 0.00 0.00 68.15 68.41 1wfz h THR 87 CO 0.04 0.00 -0.11 0.44 -0.25 0.00 0.00 175.52 175.64 1wfz h ASP 88 N 0.01 -0.38 0.60 5.36 3.32 -2.00 -0.60 116.42 122.73 1wfz h ASP 88 Ca 0.46 0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.58 1wfz h ASP 88 Cb 0.74 0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.52 1wfz h ASP 88 CO -0.94 -0.14 -0.31 0.40 -1.72 0.00 0.00 179.24 176.54 1wfz h ILE 89 N -0.06 0.37 -0.85 0.35 2.04 -0.64 0.43 117.51 119.16 1wfz h ILE 89 Ca 0.14 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.21 1wfz h ILE 89 Cb 0.28 0.37 -0.12 0.00 -0.74 0.00 0.00 36.82 36.61 1wfz h ILE 89 CO -0.32 0.00 0.32 0.00 0.00 0.00 0.00 178.15 178.15 1wfz h ALA 90 N -0.44 1.28 -0.12 1.87 0.00 -0.78 0.11 119.26 121.19 1wfz h ALA 90 Ca -0.08 0.17 -0.22 0.00 0.00 0.00 0.00 54.91 54.78 1wfz h ALA 90 Cb 0.65 0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.63 1wfz h ALA 90 CO 0.12 -0.35 -0.79 -0.22 0.00 0.00 0.00 179.25 178.01 1wfz h LYS 91 N 0.35 0.68 0.37 0.00 3.64 -0.84 0.12 116.57 120.89 1wfz h LYS 91 Ca 0.52 -0.57 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1wfz h LYS 91 Cb 0.96 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 1wfz h LYS 91 CO -0.54 1.19 -0.27 0.93 -2.27 0.00 0.00 179.45 178.49 1wfz h GLU 92 N 0.46 -0.61 0.00 1.90 4.39 0.22 -2.56 114.58 118.38 1wfz h GLU 92 Ca -0.05 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1wfz h GLU 92 Cb 1.41 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 30.20 1wfz h GLU 92 CO 0.15 -0.41 0.00 -0.07 -1.16 0.00 0.00 179.01 177.53 1wfz h LEU 93 N -0.63 0.00 -2.02 1.33 4.07 -1.05 -3.48 115.31 113.53 1wfz h LEU 93 Ca -0.03 0.00 -0.32 0.00 0.08 0.00 0.00 57.88 57.61 1wfz h LEU 93 Cb 0.54 0.00 0.16 0.00 1.08 0.00 0.00 40.66 42.45 1wfz h LEU 93 CO 0.01 0.00 -0.82 0.00 -1.08 0.00 0.00 178.44 176.55 1wfz s LEU 95 N -6.07 3.92 1.03 0.00 0.05 -0.94 -5.04 118.68 111.64 1wfz s LEU 95 Ca 0.18 0.99 -0.13 0.00 0.05 0.00 0.00 54.13 55.23 1wfz s LEU 95 Cb -0.03 -3.85 0.21 0.00 -2.05 0.00 0.00 46.19 40.47 1wfz s LEU 95 CO 0.75 -0.32 1.09 -2.16 -0.55 0.00 0.00 176.35 175.17 1wfz s PRO 96 N -3.70 0.16 0.25 1.48 0.04 -1.26 -4.93 135.00 127.04 1wfz s PRO 96 Ca 0.49 0.43 0.23 0.00 0.04 0.00 0.00 61.00 62.19 1wfz s PRO 96 Cb -0.10 -1.71 0.97 0.00 0.04 0.00 0.00 34.50 33.69 1wfz s PRO 96 CO 0.30 -2.90 1.70 -0.35 0.04 0.00 0.00 177.00 175.80 1wfz n PRO 97 N -4.28 0.19 0.09 0.56 -0.04 -1.26 -2.59 135.00 127.67 1wfz n PRO 97 Ca 0.06 0.42 -0.13 0.00 -0.04 0.00 0.00 63.50 63.81 1wfz n PRO 97 Cb 0.58 -1.86 -0.13 0.00 -0.04 0.00 0.00 33.50 32.04 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 1.56 -0.67 0.52 3.04 -2.05 -3.25 116.25 115.40 1wfz h VAL 98 Ca 0.00 -3.18 -0.28 0.00 -1.01 0.00 0.00 66.70 62.23 1wfz h VAL 98 Cb 0.35 2.90 -0.17 0.00 -2.01 0.00 0.00 31.29 32.37 1wfz h VAL 98 CO 0.00 0.92 0.35 0.29 -1.01 0.00 0.00 177.57 178.12 1wfz n LYS 99 N -3.46 2.60 -0.08 4.17 4.76 -1.07 -4.46 118.16 120.62 1wfz n LYS 99 Ca -0.06 -2.35 -0.11 0.00 -2.87 0.00 0.00 58.31 52.92 1wfz n LYS 99 Cb 1.00 -1.97 -0.04 0.00 -1.84 0.00 0.00 35.03 32.18 1wfz n LYS 99 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1wfz h LEU 100 N 1.64 0.37 -1.10 -0.35 3.38 -1.60 -2.87 115.31 114.77 1wfz h LEU 100 Ca 0.34 -0.22 0.42 0.00 0.09 0.00 0.00 57.88 58.51 1wfz h LEU 100 Cb 2.20 -0.10 -0.15 0.00 0.09 0.00 0.00 40.66 42.71 1wfz h LEU 100 CO 0.71 0.49 0.66 0.00 0.09 0.00 0.00 178.44 180.39 1wfz n HIS 101 N -4.74 0.89 0.23 1.13 1.44 -1.26 -0.60 115.22 112.32 1wfz n HIS 101 Ca -0.03 0.90 -0.09 0.00 -2.01 0.00 0.00 57.72 56.48 1wfz n HIS 101 Cb 0.17 -1.32 -0.04 0.00 0.12 0.00 0.00 29.99 28.92 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 -4.17 -0.43 -0.14 0.00 3.41 0.24 0.21 113.62 112.74 1wfz n SER 103 Ca -0.08 1.22 -0.11 0.00 -0.26 0.00 0.00 58.87 59.65 1wfz n SER 103 Cb 0.24 -0.29 0.02 0.00 -0.26 0.00 0.00 64.21 63.92 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 0.95 -0.84 4.33 -0.00 -1.54 -3.08 114.93 114.75 1wfz h MET 104 Ca 0.26 -0.41 0.20 0.00 -0.00 0.00 0.00 59.70 59.74 1wfz h MET 104 Cb 0.43 -0.03 -0.12 0.00 -0.00 0.00 0.00 31.60 31.88 1wfz h MET 104 CO -0.70 1.07 0.31 1.25 -0.00 0.00 0.00 176.91 178.85 1wfz h LEU 105 N 0.81 0.22 -0.87 -0.10 5.85 0.41 0.21 115.31 121.83 1wfz h LEU 105 Ca 0.10 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 1wfz h LEU 105 Cb 0.80 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 1wfz h LEU 105 CO 0.07 -0.01 0.53 0.00 -0.34 0.00 0.00 178.44 178.69 1wfz h ALA 106 N 1.67 1.11 -0.18 1.25 0.00 -1.18 -0.98 119.26 120.95 1wfz h ALA 106 Ca 0.50 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.30 1wfz h ALA 106 Cb 0.91 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1wfz h ALA 106 CO -0.52 0.57 0.05 1.49 0.00 0.00 0.00 179.25 180.84 1wfz h GLU 107 N 1.20 0.29 -0.57 0.00 4.81 -0.69 -2.30 114.58 117.31 1wfz h GLU 107 Ca 0.31 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1wfz h GLU 107 Cb -0.05 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 1wfz h GLU 107 CO -0.06 0.41 0.37 -0.44 -0.73 0.00 0.00 179.01 178.56 1wfz h ASP 108 N 0.12 0.67 -0.38 1.04 5.19 -0.93 -2.38 116.42 119.74 1wfz h ASP 108 Ca 0.06 -0.03 0.04 0.00 -0.62 0.00 0.00 57.03 56.48 1wfz h ASP 108 Cb 0.25 -0.17 -0.04 0.00 0.18 0.00 0.00 39.33 39.55 1wfz h ASP 108 CO -0.00 0.50 0.14 0.00 -3.12 0.00 0.00 179.24 176.75 1wfz h ALA 109 N 1.20 0.44 0.53 3.45 0.00 -1.07 -1.25 119.26 122.56 1wfz h ALA 109 Ca 0.21 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1wfz h ALA 109 Cb -0.07 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1wfz h ALA 109 CO -0.04 -0.25 -0.37 0.82 0.00 0.00 0.00 179.25 179.40 1wfz h ILE 110 N 0.29 0.00 -0.49 0.00 2.04 -1.12 -2.33 117.51 115.91 1wfz h ILE 110 Ca 0.17 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.12 1wfz h ILE 110 Cb 0.15 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.13 1wfz h ILE 110 CO -0.17 0.00 -0.38 0.11 0.00 0.00 0.00 178.15 177.71 1wfz h LYS 111 N -0.86 -0.24 -0.90 2.37 6.56 -1.36 0.69 116.57 122.84 1wfz h LYS 111 Ca -0.07 0.02 0.25 0.00 -1.06 0.00 0.00 60.65 59.78 1wfz h LYS 111 Cb 0.71 0.05 -0.14 0.00 -0.57 0.00 0.00 32.23 32.28 1wfz h LYS 111 CO 0.04 -0.16 0.28 0.00 -2.06 0.00 0.00 179.45 177.55 1wfz h ALA 112 N 0.69 1.36 -0.31 3.86 0.00 -1.15 -0.06 119.26 123.66 1wfz h ALA 112 Ca 0.18 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1wfz h ALA 112 Cb 0.56 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1wfz h ALA 112 CO -0.62 -0.48 0.00 0.00 0.00 0.00 0.00 179.25 178.15 1wfz n ALA 113 N -2.66 -0.31 0.05 0.00 0.00 0.22 -0.77 120.51 117.04 1wfz n ALA 113 Ca 0.23 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.52 1wfz n ALA 113 Cb 0.72 0.15 -0.09 0.00 0.00 0.00 0.00 19.45 20.23 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 -1.52 -0.40 0.00 -0.00 -1.26 -1.66 115.31 110.48 1wfz h LEU 114 Ca 0.00 0.17 0.04 0.00 -0.00 0.00 0.00 57.88 58.09 1wfz h LEU 114 Cb 0.00 0.58 -0.05 0.00 -0.00 0.00 0.00 40.66 41.19 1wfz h LEU 114 CO 0.00 -0.48 -0.26 0.00 -0.00 0.00 0.00 178.44 177.70 1wfz h ALA 115 N -0.52 -0.29 -0.82 1.53 0.00 -1.05 0.14 119.26 118.25 1wfz h ALA 115 Ca 0.01 0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.14 1wfz h ALA 115 Cb 0.66 1.12 -0.15 0.00 0.00 0.00 0.00 17.79 19.42 1wfz h ALA 115 CO -0.33 -0.46 -0.15 0.22 0.00 0.00 0.00 179.25 178.53 1wfz h ASP 116 N -0.03 -0.66 -0.96 0.00 3.58 -0.73 0.60 116.42 118.21 1wfz h ASP 116 Ca 0.06 0.24 0.06 0.00 0.42 0.00 0.00 57.03 57.81 1wfz h ASP 116 Cb 0.19 0.48 -0.06 0.00 1.72 0.00 0.00 39.33 41.66 1wfz h ASP 116 CO -0.39 -0.26 0.63 0.22 -2.88 0.00 0.00 179.24 176.56 1wfz h TYR 117 N 0.02 1.15 -0.28 0.28 3.20 0.12 -2.31 116.97 119.16 1wfz h TYR 117 Ca 0.41 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.24 1wfz h TYR 117 Cb 0.67 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 1wfz h TYR 117 CO -0.59 0.62 -0.08 0.87 -1.64 0.00 0.00 178.16 177.33 1wfz h LYS 118 N 1.14 0.55 -0.80 1.82 1.57 0.25 -3.06 116.57 118.04 1wfz h LYS 118 Ca 0.41 -0.22 0.19 0.00 -1.87 0.00 0.00 60.65 59.16 1wfz h LYS 118 Cb 0.13 -0.03 -0.13 0.00 0.08 0.00 0.00 32.23 32.29 1wfz h LYS 118 CO -0.15 0.77 0.15 -0.07 -0.57 0.00 0.00 179.45 179.57 1wfz h LEU 119 N 0.31 -0.11 -1.01 2.94 3.38 -0.29 0.42 115.31 120.96 1wfz h LEU 119 Ca 0.07 0.18 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 1wfz h LEU 119 Cb 0.57 0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 1wfz h LEU 119 CO 0.03 -0.13 0.17 0.11 0.09 0.00 0.00 178.44 178.71 1wfz h LYS 120 N 0.19 0.89 -0.20 1.13 1.57 -1.46 0.05 116.57 118.74 1wfz h LYS 120 Ca 0.47 -0.17 -0.09 0.00 -1.87 0.00 0.00 60.65 58.99 1wfz h LYS 120 Cb 0.88 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 1wfz h LYS 120 CO -0.62 0.77 -0.26 1.96 -0.57 0.00 0.00 179.45 180.74 1wfz h GLN 121 N 0.86 0.36 -0.01 3.15 1.08 -0.16 -2.29 115.11 118.10 1wfz h GLN 121 Ca 0.19 -0.13 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1wfz h GLN 121 Cb 0.27 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.67 1wfz h GLN 121 CO -0.01 0.60 -0.09 -0.85 -0.95 0.00 0.00 178.83 177.54 1wfz n GLU 122 N -4.13 1.46 -3.66 1.46 0.28 -0.08 -4.96 120.64 111.00 1wfz n GLU 122 Ca -0.01 -0.89 -0.22 0.00 -0.16 0.00 0.00 57.16 55.88 1wfz n GLU 122 Cb 0.39 -1.48 0.04 0.00 1.43 0.00 0.00 31.44 31.81 1wfz n GLU 122 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1wfz n SER 123 N 0.01 -2.12 -3.27 -1.84 2.88 -0.08 -4.98 113.62 104.22 1wfz n SER 123 Ca 0.16 -0.84 0.03 0.00 -1.33 0.00 0.00 58.87 56.90 1wfz n SER 123 Cb 0.37 -4.05 -0.02 0.00 -0.75 0.00 0.00 64.21 59.76 1wfz n SER 123 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1wfz s LYS 124 N -5.86 0.45 0.04 -1.46 2.20 -0.70 -5.04 119.74 109.37 1wfz s LYS 124 Ca 0.10 0.89 0.00 0.00 -0.36 0.00 0.00 55.97 56.60 1wfz s LYS 124 Cb -0.03 0.51 0.00 0.00 -1.51 0.00 0.00 37.83 36.80 1wfz s LYS 124 CO 0.81 -0.39 0.00 0.45 -0.36 0.00 0.00 175.35 175.87 1wfz n SER 125 N 5.39 0.05 0.00 1.43 2.88 -1.26 -4.65 113.62 117.45 1wfz n SER 125 Ca -0.05 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 1wfz n SER 125 Cb 0.51 0.03 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 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 2.05 2.34 3.75 0.46 0.00 -1.26 -4.71 105.19 107.82 1wfz n GLY 126 Ca 0.00 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.13 1wfz n GLY 126 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wfz s PRO 127 N 0.00 4.43 -0.04 1.61 0.04 -1.26 -5.04 135.00 134.74 1wfz s PRO 127 Ca 0.00 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.08 1wfz s PRO 127 Cb 0.00 -3.16 0.03 0.00 0.04 0.00 0.00 34.50 31.41 1wfz s PRO 127 CO 0.00 -0.14 0.01 0.45 0.04 0.00 0.00 177.00 177.36 1wfz s SER 128 N -0.12 0.94 0.87 6.66 0.15 -1.26 -5.14 113.70 115.79 1wfz s SER 128 Ca 0.52 -0.02 -0.14 0.00 0.70 0.00 0.00 55.95 57.01 1wfz s SER 128 Cb -0.36 -0.27 0.01 0.00 -1.71 0.00 0.00 66.02 63.69 1wfz s SER 128 CO 0.43 -0.16 0.48 -1.54 1.20 0.00 0.00 173.24 173.65 1wfz n SER 129 N 4.69 -1.65 0.00 5.45 3.41 -1.26 -5.29 113.62 118.97 1wfz n SER 129 Ca -0.16 0.43 0.00 0.00 -0.26 0.00 0.00 58.87 58.88 1wfz n SER 129 Cb 0.50 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.23 1wfz n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49