#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 -4.69 -4.08 1.61 7.64 -1.26 -4.97 113.62 107.87 1wfz n SER 2 Ca 0.00 -0.58 -0.35 0.00 1.01 0.00 0.00 58.87 58.95 1wfz n SER 2 Cb 0.00 -5.04 -0.12 0.00 -1.01 0.00 0.00 64.21 58.05 1wfz n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1wfz s SER 3 N -3.72 5.08 0.00 6.43 1.04 -1.26 -5.01 113.70 116.26 1wfz s SER 3 Ca 0.36 -2.41 0.00 0.00 0.48 0.00 0.00 55.95 54.38 1wfz s SER 3 Cb -0.16 -1.79 0.00 0.00 0.10 0.00 0.00 66.02 64.17 1wfz s SER 3 CO 0.73 -0.43 0.81 0.61 0.98 0.00 0.00 173.24 175.94 1wfz n GLY 4 N 4.04 -3.14 2.94 7.32 0.00 -1.26 -4.47 105.19 110.62 1wfz n GLY 4 Ca 0.02 0.47 -0.30 0.00 0.00 0.00 0.00 46.02 46.22 1wfz n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wfz s SER 5 N -2.71 3.58 -0.15 1.61 0.15 -1.26 -5.01 113.70 109.91 1wfz s SER 5 Ca 0.00 -1.03 -0.25 0.00 0.70 0.00 0.00 55.95 55.38 1wfz s SER 5 Cb 0.00 -1.15 -0.22 0.00 -1.71 0.00 0.00 66.02 62.94 1wfz s SER 5 CO 0.00 -0.21 0.56 0.28 1.20 0.00 0.00 173.24 175.07 1wfz h SER 6 N 7.99 0.00 0.00 5.45 0.02 -2.03 -3.50 113.55 121.48 1wfz h SER 6 Ca -0.21 -0.78 0.00 0.00 -0.84 0.00 0.00 61.79 59.95 1wfz h SER 6 Cb 1.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.62 1wfz h SER 6 CO 0.43 1.07 0.00 0.61 -1.14 0.00 0.00 176.83 177.79 1wfz n GLY 7 N 1.58 0.75 3.93 -3.77 0.00 -1.26 -5.13 105.19 101.28 1wfz n GLY 7 Ca -0.14 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 1wfz n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wfz s GLU 8 N -0.76 3.46 0.15 1.61 2.12 -1.26 -5.12 118.70 118.90 1wfz s GLU 8 Ca 0.00 -0.45 0.08 0.00 0.36 0.00 0.00 54.97 54.96 1wfz s GLU 8 Cb 0.00 -2.99 -0.04 0.00 0.26 0.00 0.00 34.13 31.36 1wfz s GLU 8 CO 0.00 0.56 -0.08 -0.80 -0.54 0.00 0.00 175.26 174.40 1wfz s ASN 9 N -2.74 4.42 0.72 -1.70 0.01 -1.26 -5.14 114.94 109.26 1wfz s ASN 9 Ca 0.36 -0.46 0.00 0.00 -0.71 0.00 0.00 52.86 52.05 1wfz s ASN 9 Cb -0.12 -0.83 0.00 0.00 0.41 0.00 0.00 41.25 40.70 1wfz s ASN 9 CO 0.28 0.13 0.00 -0.81 -1.51 0.00 0.00 177.10 175.19 1wfz n PRO 10 N 0.29 -0.47 0.00 -0.60 -0.04 -1.26 -5.08 135.00 127.84 1wfz n PRO 10 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 1wfz n PRO 10 Cb 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 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 -1.10 0.00 0.00 0.54 0.00 -1.26 -5.04 116.66 109.81 1wfz n ARG 11 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1wfz n ARG 11 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1wfz n ARG 11 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1wfz n ASN 12 N -2.51 0.00 -4.12 6.15 5.15 -1.26 -4.99 115.26 113.68 1wfz n ASN 12 Ca 0.00 0.04 -0.29 0.00 -0.60 0.00 0.00 54.58 53.73 1wfz n ASN 12 Cb 0.00 -0.46 -0.05 0.00 -0.53 0.00 0.00 39.78 38.74 1wfz n ASN 12 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1wfz n VAL 13 N -2.38 -2.08 0.00 3.44 0.31 -1.26 -4.95 118.33 111.41 1wfz n VAL 13 Ca 0.00 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.91 1wfz n VAL 13 Cb 0.00 -1.96 0.00 0.00 -0.91 0.00 0.00 33.84 30.97 1wfz n VAL 13 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wfz n GLY 14 N -2.06 0.46 3.22 2.92 0.00 -1.26 -4.89 105.19 103.58 1wfz n GLY 14 Ca -0.25 -0.05 0.04 0.00 0.00 0.00 0.00 46.02 45.76 1wfz n GLY 14 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wfz s SER 15 N -1.10 -0.40 0.37 1.61 0.01 -1.26 -4.88 113.70 108.05 1wfz s SER 15 Ca 0.00 0.38 0.07 0.00 1.31 0.00 0.00 55.95 57.71 1wfz s SER 15 Cb 0.00 1.38 -0.02 0.00 0.21 0.00 0.00 66.02 67.60 1wfz s SER 15 CO 0.00 -0.08 0.39 -0.76 0.41 0.00 0.00 173.24 173.20 1wfz s LEU 16 N 2.64 3.60 0.15 2.44 1.43 -1.26 -5.09 118.68 122.60 1wfz s LEU 16 Ca -0.01 -0.51 -0.30 0.00 -1.03 0.00 0.00 54.13 52.27 1wfz s LEU 16 Cb -0.07 -2.32 -0.07 0.00 0.03 0.00 0.00 46.19 43.76 1wfz s LEU 16 CO -0.14 -0.52 1.15 -0.62 0.23 0.00 0.00 176.35 176.46 1wfz s ASP 17 N -4.12 7.16 -0.19 2.29 -1.08 -1.26 -4.95 116.67 114.53 1wfz s ASP 17 Ca 0.46 2.11 -0.02 0.00 -0.52 0.00 0.00 52.55 54.58 1wfz s ASP 17 Cb -0.06 -2.60 -0.21 0.00 -1.46 0.00 0.00 42.92 38.58 1wfz s ASP 17 CO 0.29 -0.33 0.06 2.29 0.52 0.00 0.00 175.17 178.00 1wfz n LYS 18 N 2.81 0.70 -0.11 4.34 2.85 -1.26 -4.35 118.16 123.15 1wfz n LYS 18 Ca 0.05 0.20 -0.05 0.00 -1.05 0.00 0.00 58.31 57.46 1wfz n LYS 18 Cb 0.46 -1.61 0.14 0.00 -0.65 0.00 0.00 35.03 33.36 1wfz n LYS 18 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1wfz h THR 19 N 0.03 1.25 -1.72 0.58 1.35 -1.92 -3.45 112.91 109.03 1wfz h THR 19 Ca -0.50 -1.08 -0.51 0.00 -0.55 0.00 0.00 66.41 63.77 1wfz h THR 19 Cb 1.97 0.94 0.25 0.00 -1.73 0.00 0.00 68.15 69.57 1wfz h THR 19 CO -0.00 0.38 -2.03 -1.20 -0.25 0.00 0.00 175.52 172.41 1wfz n SER 20 N -4.19 -3.77 -0.03 5.36 7.64 -1.26 -4.94 113.62 112.43 1wfz n SER 20 Ca 0.02 0.07 0.02 0.00 1.01 0.00 0.00 58.87 59.99 1wfz n SER 20 Cb 0.33 -0.71 -0.10 0.00 -1.01 0.00 0.00 64.21 62.71 1wfz n SER 20 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1wfz n LYS 21 N 1.44 0.98 0.17 1.43 2.85 -1.26 -4.45 118.16 119.32 1wfz n LYS 21 Ca -0.01 -0.08 0.05 0.00 -1.05 0.00 0.00 58.31 57.22 1wfz n LYS 21 Cb 0.66 -1.32 0.14 0.00 -0.65 0.00 0.00 35.03 33.85 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 0.00 0.00 -3.43 -5.58 -1.07 -1.92 -3.44 115.58 100.14 1wfz h ASN 22 Ca -0.13 0.00 -0.66 0.00 0.07 0.00 0.00 56.30 55.58 1wfz h ASN 22 Cb 1.06 0.00 -0.21 0.00 -2.07 0.00 0.00 38.32 37.10 1wfz h ASN 22 CO 0.01 0.38 -0.68 0.54 0.07 0.00 0.00 177.43 177.75 1wfz s VAL 23 N -3.15 3.79 0.52 6.14 0.11 -1.26 0.42 120.40 126.98 1wfz s VAL 23 Ca 0.04 -0.41 0.02 0.00 -2.93 0.00 0.00 61.98 58.69 1wfz s VAL 23 Cb 0.08 -2.61 0.03 0.00 -1.53 0.00 0.00 36.38 32.34 1wfz s VAL 23 CO 0.71 0.54 0.73 -0.83 -3.33 0.00 0.00 175.10 172.92 1wfz s GLY 24 N -0.13 1.81 -0.11 6.54 0.00 -0.20 -4.72 107.32 110.51 1wfz s GLY 24 Ca 0.02 -1.35 -0.03 0.00 0.00 0.00 0.00 44.72 43.36 1wfz s GLY 24 CO 0.03 -1.10 0.04 -1.59 0.00 0.00 0.00 173.10 170.48 1wfz s THR 25 N -2.67 0.22 -0.25 0.90 2.01 -1.26 -3.19 115.64 111.39 1wfz s THR 25 Ca 0.56 -0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.55 1wfz s THR 25 Cb -0.10 -0.57 0.07 0.00 0.01 0.00 0.00 72.50 71.90 1wfz s THR 25 CO 0.37 0.03 -0.05 -0.83 -0.69 0.00 0.00 174.62 173.46 1wfz s GLY 26 N 2.02 1.41 -0.15 4.40 0.00 -0.34 -4.47 107.32 110.18 1wfz s GLY 26 Ca 0.03 -1.56 -0.03 0.00 0.00 0.00 0.00 44.72 43.17 1wfz s GLY 26 CO -0.06 0.90 -0.06 -2.27 0.00 0.00 0.00 173.10 171.61 1wfz s LEU 27 N 1.31 3.09 -0.10 0.66 2.96 -1.26 0.10 118.68 125.42 1wfz s LEU 27 Ca -0.04 -0.19 -0.04 0.00 -0.22 0.00 0.00 54.13 53.64 1wfz s LEU 27 Cb -0.19 -1.73 0.05 0.00 0.50 0.00 0.00 46.19 44.82 1wfz s LEU 27 CO -0.07 0.16 0.22 0.68 -1.32 0.00 0.00 176.35 176.02 1wfz s VAL 28 N 0.38 -0.26 0.44 1.68 -7.23 -0.22 -4.99 120.40 110.20 1wfz s VAL 28 Ca -0.06 0.27 0.04 0.00 -1.81 0.00 0.00 61.98 60.42 1wfz s VAL 28 Cb -0.15 -0.36 -0.05 0.00 0.56 0.00 0.00 36.38 36.38 1wfz s VAL 28 CO 0.04 0.11 0.02 -0.83 -0.31 0.00 0.00 175.10 174.13 1wfz s GLY 29 N 2.03 2.66 -0.18 2.32 0.00 -1.26 -1.93 107.32 110.96 1wfz s GLY 29 Ca -0.01 -1.48 -0.08 0.00 0.00 0.00 0.00 44.72 43.14 1wfz s GLY 29 CO -0.07 -2.08 0.09 0.00 0.00 0.00 0.00 173.10 171.04 1wfz s ALA 30 N -2.88 3.56 0.17 3.20 0.00 -0.77 -4.87 121.76 120.17 1wfz s ALA 30 Ca 0.24 -0.71 -0.08 0.00 0.00 0.00 0.00 51.96 51.41 1wfz s ALA 30 Cb 0.06 -2.00 0.05 0.00 0.00 0.00 0.00 23.12 21.23 1wfz s ALA 30 CO 0.12 0.25 1.51 -1.00 0.00 0.00 0.00 175.76 176.64 1wfz h PRO 31 N 6.40 0.81 0.00 0.00 0.13 -1.96 0.26 132.00 137.64 1wfz h PRO 31 Ca -0.41 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.29 1wfz h PRO 31 Cb 1.17 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1wfz h PRO 31 CO 0.70 1.06 -0.01 0.00 -0.23 0.00 0.00 178.00 179.52 1wfz h ALA 32 N 0.89 0.00 -0.14 -0.56 0.00 -1.99 -3.36 119.26 114.09 1wfz h ALA 32 Ca 0.05 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1wfz h ALA 32 Cb 0.96 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1wfz h ALA 32 CO 0.09 0.01 0.12 0.00 0.00 0.00 0.00 179.25 179.47 1wfz n GLY 34 N -1.47 -0.11 3.70 0.00 0.00 0.06 -4.86 105.19 102.50 1wfz n GLY 34 Ca 0.01 0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.23 4.73 -0.33 1.61 1.01 -1.08 -4.76 116.67 114.62 1wfz s ASP 35 Ca 0.21 -0.62 -0.01 0.00 0.71 0.00 0.00 52.55 52.84 1wfz s ASP 35 Cb -0.03 -0.90 0.11 0.00 1.01 0.00 0.00 42.92 43.12 1wfz s ASP 35 CO 0.37 -0.09 0.15 -0.69 0.21 0.00 0.00 175.17 175.12 1wfz s VAL 36 N -2.32 0.60 -0.49 -1.27 1.01 -0.68 -1.85 120.40 115.39 1wfz s VAL 36 Ca 0.33 -1.50 -0.15 0.00 0.00 0.00 0.00 61.98 60.67 1wfz s VAL 36 Cb -0.06 -1.45 0.10 0.00 0.00 0.00 0.00 36.38 34.97 1wfz s VAL 36 CO 0.21 -0.79 0.42 -0.32 0.00 0.00 0.00 175.10 174.63 1wfz s MET 37 N 1.42 2.94 -0.39 2.72 1.75 -0.81 -1.17 119.30 125.76 1wfz s MET 37 Ca 0.12 -1.51 -0.16 0.00 -1.25 0.00 0.00 55.69 52.90 1wfz s MET 37 Cb -0.19 -4.17 0.01 0.00 2.84 0.00 0.00 34.83 33.32 1wfz s MET 37 CO -0.19 -1.14 0.36 0.21 -0.65 0.00 0.00 175.02 173.61 1wfz s LYS 38 N 1.60 3.19 0.11 4.11 2.47 0.42 -1.05 119.74 130.60 1wfz s LYS 38 Ca 0.04 -0.75 0.02 0.00 -1.56 0.00 0.00 55.97 53.72 1wfz s LYS 38 Cb -0.26 -3.92 -0.04 0.00 -1.46 0.00 0.00 37.83 32.15 1wfz s LYS 38 CO 0.05 -0.72 0.19 -1.17 0.16 0.00 0.00 175.35 173.86 1wfz s LEU 39 N 1.95 4.12 -0.24 5.43 2.96 0.11 -1.51 118.68 131.49 1wfz s LEU 39 Ca 0.09 0.10 -0.10 0.00 -0.22 0.00 0.00 54.13 54.00 1wfz s LEU 39 Cb -0.18 -2.73 0.10 0.00 0.50 0.00 0.00 46.19 43.89 1wfz s LEU 39 CO 0.12 0.11 0.55 -1.10 -1.32 0.00 0.00 176.35 174.71 1wfz s GLN 40 N -2.82 0.49 -0.04 1.98 -0.21 -0.67 -1.20 119.66 117.18 1wfz s GLN 40 Ca 0.33 1.19 0.04 0.00 0.02 0.00 0.00 55.36 56.94 1wfz s GLN 40 Cb -0.12 0.46 -0.00 0.00 1.00 0.00 0.00 33.01 34.35 1wfz s GLN 40 CO 0.26 -0.20 -0.16 0.96 -2.12 0.00 0.00 175.29 174.03 1wfz s ILE 41 N 2.41 1.31 -0.29 1.08 -5.25 -1.19 0.27 121.20 119.54 1wfz s ILE 41 Ca -0.06 -0.65 -0.18 0.00 -0.99 0.00 0.00 60.65 58.78 1wfz s ILE 41 Cb -0.10 -1.13 -0.02 0.00 2.95 0.00 0.00 42.46 44.15 1wfz s ILE 41 CO -0.16 0.38 0.50 -1.58 -1.79 0.00 0.00 174.94 172.29 1wfz s GLN 42 N 0.10 3.93 -0.14 0.37 0.74 0.24 -1.03 119.66 123.87 1wfz s GLN 42 Ca -0.04 0.14 -0.11 0.00 0.05 0.00 0.00 55.36 55.39 1wfz s GLN 42 Cb -0.11 -3.70 -0.05 0.00 1.10 0.00 0.00 33.01 30.25 1wfz s GLN 42 CO 0.02 -0.43 0.24 0.08 -0.55 0.00 0.00 175.29 174.65 1wfz s VAL 43 N 2.31 5.34 0.47 1.34 1.01 0.17 -1.73 120.40 129.30 1wfz s VAL 43 Ca 0.20 0.43 -0.03 0.00 0.00 0.00 0.00 61.98 62.58 1wfz s VAL 43 Cb -0.16 -3.55 0.10 0.00 0.00 0.00 0.00 36.38 32.77 1wfz s VAL 43 CO 0.11 0.48 0.64 -0.67 0.00 0.00 0.00 175.10 175.66 1wfz n ASP 44 N 2.92 0.55 0.19 3.32 2.03 -1.11 -4.56 116.55 119.88 1wfz n ASP 44 Ca -0.15 -1.54 0.05 0.00 0.52 0.00 0.00 54.79 53.67 1wfz n ASP 44 Cb 0.53 -0.44 0.48 0.00 -0.72 0.00 0.00 41.12 40.96 1wfz n ASP 44 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1wfz h GLU 45 N 0.00 0.08 0.00 -0.67 4.11 -1.97 -1.76 114.58 114.37 1wfz h GLU 45 Ca -0.21 -0.02 -0.08 0.00 0.07 0.00 0.00 59.36 59.13 1wfz h GLU 45 Cb 0.70 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1wfz h GLU 45 CO 0.20 0.23 -0.36 0.87 0.07 0.00 0.00 179.01 180.01 1wfz h LYS 46 N 0.08 0.00 0.00 1.06 1.57 -2.03 -3.47 116.57 113.77 1wfz h LYS 46 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1wfz h LYS 46 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1wfz h LYS 46 CO 0.02 0.36 0.00 0.41 -0.57 0.00 0.00 179.45 179.67 1wfz n GLY 47 N 0.95 1.13 3.62 3.86 0.00 -0.66 -5.09 105.19 109.00 1wfz n GLY 47 Ca 0.02 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.33 3.50 -0.45 1.61 2.36 -1.26 -3.06 119.74 122.10 1wfz s LYS 48 Ca 0.00 -0.41 -0.27 0.00 -2.55 0.00 0.00 55.97 52.74 1wfz s LYS 48 Cb 0.00 -2.97 -0.02 0.00 -1.05 0.00 0.00 37.83 33.79 1wfz s LYS 48 CO 0.00 0.45 1.89 0.42 1.55 0.00 0.00 175.35 179.65 1wfz s ILE 49 N -0.16 3.38 -0.14 5.43 1.01 0.84 -2.76 121.20 128.80 1wfz s ILE 49 Ca 0.05 0.32 0.18 0.00 0.00 0.00 0.00 60.65 61.20 1wfz s ILE 49 Cb -0.12 -3.69 -0.12 0.00 0.01 0.00 0.00 42.46 38.53 1wfz s ILE 49 CO 0.02 -0.56 0.83 1.33 0.00 0.00 0.00 174.94 176.56 1wfz n VAL 50 N 7.39 1.10 -4.02 2.92 0.24 -0.71 -1.57 118.33 123.69 1wfz n VAL 50 Ca 0.23 -0.67 -0.10 0.00 -2.04 0.00 0.00 64.34 61.76 1wfz n VAL 50 Cb 0.50 -0.67 -0.11 0.00 -1.47 0.00 0.00 33.84 32.08 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 -5.70 0.43 -0.14 -1.34 -1.08 -1.23 -4.81 116.67 102.79 1wfz s ASP 51 Ca -0.03 -0.59 -0.18 0.00 -0.52 0.00 0.00 52.55 51.23 1wfz s ASP 51 Cb 0.09 0.10 0.05 0.00 -1.46 0.00 0.00 42.92 41.69 1wfz s ASP 51 CO 0.81 -0.32 0.48 0.00 0.52 0.00 0.00 175.17 176.66 1wfz s ALA 52 N -1.83 -1.20 0.01 3.66 0.00 -1.26 -0.59 121.76 120.55 1wfz s ALA 52 Ca -0.11 1.19 0.02 0.00 0.00 0.00 0.00 51.96 53.06 1wfz s ALA 52 Cb -0.07 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.48 1wfz s ALA 52 CO -0.02 -0.25 -0.06 1.03 0.00 0.00 0.00 175.76 176.46 1wfz s ARG 53 N -0.18 0.45 -0.07 0.00 1.81 0.14 -4.76 118.95 116.34 1wfz s ARG 53 Ca -0.04 -0.39 0.00 0.00 -1.72 0.00 0.00 55.73 53.58 1wfz s ARG 53 Cb -0.03 -0.36 0.02 0.00 -0.45 0.00 0.00 34.95 34.13 1wfz s ARG 53 CO 0.02 0.09 -0.06 -0.59 -0.68 0.00 0.00 175.30 174.08 1wfz s PHE 54 N -0.59 1.02 -0.32 -0.53 -0.71 -1.26 -1.66 117.98 113.94 1wfz s PHE 54 Ca -0.03 -0.37 -0.01 0.00 -1.04 0.00 0.00 56.93 55.48 1wfz s PHE 54 Cb -0.05 -0.89 0.10 0.00 -1.21 0.00 0.00 43.02 40.98 1wfz s PHE 54 CO 0.00 -0.30 0.12 0.21 -1.34 0.00 0.00 175.22 173.91 1wfz s LYS 55 N 1.24 0.63 0.03 1.99 2.47 -0.57 -4.34 119.74 121.18 1wfz s LYS 55 Ca -0.05 -1.03 0.00 0.00 -1.56 0.00 0.00 55.97 53.33 1wfz s LYS 55 Cb -0.14 -1.81 -0.04 0.00 -1.46 0.00 0.00 37.83 34.39 1wfz s LYS 55 CO -0.02 -1.01 0.11 0.99 0.16 0.00 0.00 175.35 175.57 1wfz s THR 56 N 1.62 4.83 -0.22 3.43 2.01 -1.25 -0.44 115.64 125.62 1wfz s THR 56 Ca 0.10 -0.47 -0.02 0.00 0.31 0.00 0.00 61.69 61.61 1wfz s THR 56 Cb -0.18 -3.26 0.07 0.00 0.01 0.00 0.00 72.50 69.14 1wfz s THR 56 CO -0.25 0.26 0.04 -0.36 -0.69 0.00 0.00 174.62 173.62 1wfz s PHE 57 N -1.30 1.33 0.00 4.92 0.08 -0.32 -4.92 117.98 117.77 1wfz s PHE 57 Ca 0.26 -1.15 0.00 0.00 0.12 0.00 0.00 56.93 56.17 1wfz s PHE 57 Cb -0.12 -1.23 0.00 0.00 -0.57 0.00 0.00 43.02 41.10 1wfz s PHE 57 CO 0.18 -0.69 0.00 0.41 -0.10 0.00 0.00 175.22 175.02 1wfz n GLY 58 N 4.96 0.13 3.74 4.36 0.00 -1.26 -1.68 105.19 115.44 1wfz n GLY 58 Ca -0.08 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.64 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 0.80 -0.18 -1.07 0.00 0.00 -1.99 -2.59 103.07 98.03 1wfz h GLY 60 Ca -0.51 0.07 0.38 0.00 0.00 0.00 0.00 47.33 47.27 1wfz h GLY 60 CO 0.54 -0.07 0.68 1.44 0.00 0.00 0.00 176.54 179.13 1wfz n SER 61 N -5.17 0.18 -0.00 0.19 7.64 -1.26 0.22 113.62 115.42 1wfz n SER 61 Ca -0.08 1.14 -0.17 0.00 1.01 0.00 0.00 58.87 60.77 1wfz n SER 61 Cb 0.10 -0.56 -0.11 0.00 -1.01 0.00 0.00 64.21 62.64 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 1.32 0.09 -0.84 -0.43 0.00 -1.83 -2.95 119.26 114.62 1wfz h ALA 62 Ca 0.70 -0.55 0.02 0.00 0.00 0.00 0.00 54.91 55.08 1wfz h ALA 62 Cb 2.22 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.99 1wfz h ALA 62 CO -0.41 0.34 0.56 0.82 0.00 0.00 0.00 179.25 180.56 1wfz h ILE 63 N -0.08 1.19 0.02 0.00 2.04 0.28 -2.33 117.51 118.63 1wfz h ILE 63 Ca -0.07 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 1wfz h ILE 63 Cb 1.27 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1wfz h ILE 63 CO 0.11 0.20 -0.01 0.00 0.00 0.00 0.00 178.15 178.46 1wfz h ALA 64 N 1.49 -0.74 -0.96 1.87 0.00 -1.10 -2.07 119.26 117.75 1wfz h ALA 64 Ca 0.32 -0.01 0.22 0.00 0.00 0.00 0.00 54.91 55.44 1wfz h ALA 64 Cb -0.08 0.01 -0.18 0.00 0.00 0.00 0.00 17.79 17.54 1wfz h ALA 64 CO -0.08 -0.74 -0.15 0.43 0.00 0.00 0.00 179.25 178.71 1wfz n SER 65 N -2.09 -0.27 0.11 0.00 7.64 -1.12 -1.30 113.62 116.60 1wfz n SER 65 Ca -0.00 1.64 -0.06 0.00 1.01 0.00 0.00 58.87 61.46 1wfz n SER 65 Cb 0.01 -0.53 -0.03 0.00 -1.01 0.00 0.00 64.21 62.65 1wfz n SER 65 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1wfz h SER 66 N 0.00 -0.40 -1.00 6.43 4.64 -1.46 0.30 113.55 122.06 1wfz h SER 66 Ca 0.50 0.03 0.36 0.00 -0.47 0.00 0.00 61.79 62.21 1wfz h SER 66 Cb 0.86 0.13 -0.18 0.00 -0.31 0.00 0.00 62.40 62.90 1wfz h SER 66 CO -0.96 -0.21 0.37 -1.28 -0.87 0.00 0.00 176.83 173.88 1wfz h SER 67 N -0.33 0.07 -0.15 4.97 0.87 -0.45 0.71 113.55 119.24 1wfz h SER 67 Ca -0.02 0.26 -0.07 0.00 -1.23 0.00 0.00 61.79 60.73 1wfz h SER 67 Cb 0.28 0.33 -0.00 0.00 -0.44 0.00 0.00 62.40 62.57 1wfz h SER 67 CO 0.00 -0.39 -0.16 0.25 -0.53 0.00 0.00 176.83 176.00 1wfz h LEU 68 N 0.02 0.40 0.84 2.23 6.46 -0.86 -2.97 115.31 121.43 1wfz h LEU 68 Ca 0.76 -0.49 -0.04 0.00 -0.12 0.00 0.00 57.88 57.99 1wfz h LEU 68 Cb 1.87 -0.11 0.01 0.00 -0.73 0.00 0.00 40.66 41.70 1wfz h LEU 68 CO -0.81 0.81 -0.40 0.00 -0.62 0.00 0.00 178.44 177.41 1wfz h ALA 69 N 0.60 -1.29 -0.28 1.25 0.00 0.41 -1.46 119.26 118.49 1wfz h ALA 69 Ca 0.02 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 54.76 1wfz h ALA 69 Cb 0.70 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1wfz h ALA 69 CO 0.04 -1.21 0.64 0.00 0.00 0.00 0.00 179.25 178.73 1wfz h THR 70 N -1.14 0.10 0.00 0.00 1.03 -0.77 1.13 112.91 113.26 1wfz h THR 70 Ca -0.12 0.00 -0.23 0.00 -0.01 0.00 0.00 66.41 66.05 1wfz h THR 70 Cb 0.87 0.42 -0.04 0.00 -1.07 0.00 0.00 68.15 68.33 1wfz h THR 70 CO 0.19 0.00 -1.31 -0.08 -0.01 0.00 0.00 175.52 174.31 1wfz h GLU 71 N 0.00 0.00 -0.14 0.00 4.81 -1.24 -3.26 114.58 114.75 1wfz h GLU 71 Ca 0.13 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.21 1wfz h GLU 71 Cb 1.42 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.79 1wfz h GLU 71 CO -0.00 0.66 -0.58 -1.49 -0.73 0.00 0.00 179.01 176.88 1wfz h TRP 72 N 0.00 0.58 -0.27 0.92 4.06 0.24 -3.12 115.95 118.35 1wfz h TRP 72 Ca -0.15 -0.21 -0.13 0.00 2.06 0.00 0.00 58.89 60.46 1wfz h TRP 72 Cb 1.83 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 29.87 1wfz h TRP 72 CO 0.00 0.92 -0.37 -0.39 -3.56 0.00 0.00 178.44 175.05 1wfz h VAL 73 N 0.34 1.29 -2.17 1.49 -1.51 -1.53 -3.41 116.25 110.76 1wfz h VAL 73 Ca 0.00 -1.51 -0.63 0.00 -1.23 0.00 0.00 66.70 63.33 1wfz h VAL 73 Cb 1.11 1.48 0.07 0.00 -2.13 0.00 0.00 31.29 31.82 1wfz h VAL 73 CO 0.10 0.48 0.46 0.29 -1.23 0.00 0.00 177.57 177.67 1wfz n LYS 74 N -4.05 1.53 0.00 5.19 5.02 -1.18 -0.67 118.16 124.00 1wfz n LYS 74 Ca -0.01 0.55 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 1wfz n LYS 74 Cb 0.50 -2.14 0.00 0.00 -0.02 0.00 0.00 35.03 33.36 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 2.27 2.66 3.96 0.72 0.00 -0.61 -4.99 105.19 109.21 1wfz n GLY 75 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 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 1.77 0.26 1.61 1.02 0.16 -4.72 119.74 119.84 1wfz s LYS 76 Ca 0.00 -0.72 0.07 0.00 0.02 0.00 0.00 55.97 55.34 1wfz s LYS 76 Cb 0.00 -2.23 -0.03 0.00 -0.52 0.00 0.00 37.83 35.05 1wfz s LYS 76 CO 0.00 -1.44 0.27 0.95 -0.92 0.00 0.00 175.35 174.20 1wfz s THR 77 N -3.24 4.54 0.27 2.17 -4.23 -1.26 -0.11 115.64 113.78 1wfz s THR 77 Ca 0.65 -1.27 -0.00 0.00 -1.18 0.00 0.00 61.69 59.89 1wfz s THR 77 Cb -0.07 -3.50 0.27 0.00 1.34 0.00 0.00 72.50 70.54 1wfz s THR 77 CO 0.45 -0.31 1.69 -0.37 -0.54 0.00 0.00 174.62 175.53 1wfz h VAL 78 N 1.35 0.48 -0.45 2.29 -1.51 -1.92 0.68 116.25 117.17 1wfz h VAL 78 Ca -0.49 -0.12 0.01 0.00 -1.23 0.00 0.00 66.70 64.88 1wfz h VAL 78 Cb 1.24 0.11 -0.03 0.00 -2.13 0.00 0.00 31.29 30.49 1wfz h VAL 78 CO 0.60 0.06 0.28 -0.33 -1.23 0.00 0.00 177.57 176.96 1wfz h GLU 79 N 0.34 0.56 0.03 5.19 5.08 -1.95 -1.89 114.58 121.94 1wfz h GLU 79 Ca 0.50 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.83 1wfz h GLU 79 Cb 0.91 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1wfz h GLU 79 CO -0.53 0.37 -0.03 0.93 -1.00 0.00 0.00 179.01 178.75 1wfz h GLU 80 N 0.58 -0.07 -0.71 2.33 4.39 -1.31 -2.72 114.58 117.08 1wfz h GLU 80 Ca 0.17 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.98 1wfz h GLU 80 Cb -0.04 0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 28.55 1wfz h GLU 80 CO -0.05 -0.04 0.32 0.00 -1.16 0.00 0.00 179.01 178.08 1wfz h ALA 81 N 0.90 0.97 -0.42 3.43 0.00 -1.01 0.10 119.26 123.24 1wfz h ALA 81 Ca 0.00 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.11 1wfz h ALA 81 Cb 0.07 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1wfz h ALA 81 CO -0.01 -0.11 0.39 -0.07 0.00 0.00 0.00 179.25 179.45 1wfz h LEU 82 N 0.54 0.00 0.00 0.00 -0.00 -1.03 0.46 115.31 115.29 1wfz h LEU 82 Ca 0.36 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 58.19 1wfz h LEU 82 Cb 0.43 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.09 1wfz h LEU 82 CO -0.31 0.00 -0.24 0.71 -0.00 0.00 0.00 178.44 178.60 1wfz h THR 83 N 0.00 0.39 -2.38 0.22 1.35 -0.70 -3.45 112.91 108.34 1wfz h THR 83 Ca 0.20 -1.55 -0.54 0.00 -0.55 0.00 0.00 66.41 63.97 1wfz h THR 83 Cb 0.97 2.19 0.01 0.00 -1.73 0.00 0.00 68.15 69.59 1wfz h THR 83 CO -0.00 0.22 1.23 -0.63 -0.25 0.00 0.00 175.52 176.09 1wfz s ILE 84 N -3.10 3.11 0.68 6.82 1.01 0.16 -4.98 121.20 124.91 1wfz s ILE 84 Ca 0.06 0.13 -0.01 0.00 0.00 0.00 0.00 60.65 60.83 1wfz s ILE 84 Cb 0.06 -3.09 0.10 0.00 0.01 0.00 0.00 42.46 39.54 1wfz s ILE 84 CO 0.71 -0.02 0.95 -0.54 0.00 0.00 0.00 174.94 176.04 1wfz s LYS 85 N 4.55 1.92 -0.06 2.79 3.01 -1.26 -4.96 119.74 125.73 1wfz s LYS 85 Ca 0.87 -0.91 0.07 0.00 -1.01 0.00 0.00 55.97 54.98 1wfz s LYS 85 Cb -0.40 -2.34 -0.24 0.00 -1.01 0.00 0.00 37.83 33.84 1wfz s LYS 85 CO 0.39 -1.27 0.60 -2.95 0.51 0.00 0.00 175.35 172.63 1wfz h ASN 86 N -0.42 0.13 -0.36 2.83 -1.07 -1.94 -3.39 115.58 111.37 1wfz h ASN 86 Ca -0.39 -0.28 0.07 0.00 0.07 0.00 0.00 56.30 55.77 1wfz h ASN 86 Cb 1.28 -0.04 -0.09 0.00 -2.07 0.00 0.00 38.32 37.40 1wfz h ASN 86 CO 0.45 1.25 -0.37 0.71 0.07 0.00 0.00 177.43 179.55 1wfz h THR 87 N 0.02 0.19 -0.49 6.14 1.35 -1.96 -1.65 112.91 116.52 1wfz h THR 87 Ca -0.32 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 65.63 1wfz h THR 87 Cb 2.02 0.19 -0.10 0.00 -1.73 0.00 0.00 68.15 68.53 1wfz h THR 87 CO 0.09 0.00 -0.39 -0.78 -0.25 0.00 0.00 175.52 174.19 1wfz h ASP 88 N -0.31 -1.32 0.04 5.36 3.58 -2.00 -1.73 116.42 120.03 1wfz h ASP 88 Ca 0.15 0.22 0.01 0.00 0.42 0.00 0.00 57.03 57.83 1wfz h ASP 88 Cb 0.56 0.60 -0.03 0.00 1.72 0.00 0.00 39.33 42.19 1wfz h ASP 88 CO -0.52 -0.34 -0.31 0.40 -2.88 0.00 0.00 179.24 175.59 1wfz h ILE 89 N -0.25 0.00 -1.08 2.25 2.04 -1.54 0.25 117.51 119.18 1wfz h ILE 89 Ca 0.17 0.00 0.42 0.00 1.00 0.00 0.00 64.86 66.46 1wfz h ILE 89 Cb 0.56 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.48 1wfz h ILE 89 CO -0.62 0.00 0.62 0.00 0.00 0.00 0.00 178.15 178.15 1wfz h ALA 90 N -0.93 2.29 -0.05 1.87 0.00 -0.89 0.70 119.26 122.24 1wfz h ALA 90 Ca 0.00 0.23 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 1wfz h ALA 90 Cb 0.43 0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.52 1wfz h ALA 90 CO -0.18 -1.04 -0.42 -0.22 0.00 0.00 0.00 179.25 177.38 1wfz h LYS 91 N 0.04 0.38 -0.75 0.00 3.64 -0.33 0.11 116.57 119.67 1wfz h LYS 91 Ca 0.84 -0.34 0.09 0.00 -1.27 0.00 0.00 60.65 59.97 1wfz h LYS 91 Cb 2.31 0.08 -0.07 0.00 -0.41 0.00 0.00 32.23 34.14 1wfz h LYS 91 CO -0.68 0.99 0.41 1.49 -2.27 0.00 0.00 179.45 179.38 1wfz h GLU 92 N -0.11 0.68 0.00 1.90 4.57 0.37 -1.17 114.58 120.81 1wfz h GLU 92 Ca -0.04 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 1wfz h GLU 92 Cb 1.10 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.54 1wfz h GLU 92 CO 0.09 0.45 -0.49 -0.07 -1.18 0.00 0.00 179.01 177.80 1wfz h LEU 93 N 0.70 0.00 -1.75 1.64 -0.00 -1.08 -3.48 115.31 111.34 1wfz h LEU 93 Ca 0.36 -0.00 -0.37 0.00 -0.00 0.00 0.00 57.88 57.87 1wfz h LEU 93 Cb 0.33 0.00 0.11 0.00 -0.00 0.00 0.00 40.66 41.11 1wfz h LEU 93 CO -0.24 0.00 -0.80 0.00 -0.00 0.00 0.00 178.44 177.39 1wfz s LEU 95 N -6.49 3.95 1.02 0.00 0.05 -1.05 -5.04 118.68 111.12 1wfz s LEU 95 Ca 0.02 1.08 -0.13 0.00 0.05 0.00 0.00 54.13 55.15 1wfz s LEU 95 Cb -0.00 -3.92 0.20 0.00 -2.05 0.00 0.00 46.19 40.41 1wfz s LEU 95 CO 0.77 -0.29 1.09 -2.16 -0.55 0.00 0.00 176.35 175.21 1wfz s PRO 96 N -3.49 0.26 0.16 1.48 0.04 -1.26 -4.93 135.00 127.26 1wfz s PRO 96 Ca 0.50 0.46 0.20 0.00 0.04 0.00 0.00 61.00 62.21 1wfz s PRO 96 Cb -0.10 -1.72 0.84 0.00 0.04 0.00 0.00 34.50 33.55 1wfz s PRO 96 CO 0.27 -2.84 1.61 -0.35 0.04 0.00 0.00 177.00 175.73 1wfz n PRO 97 N -4.24 0.12 0.03 0.56 -0.04 -1.26 -2.47 135.00 127.70 1wfz n PRO 97 Ca 0.05 0.36 -0.07 0.00 -0.04 0.00 0.00 63.50 63.80 1wfz n PRO 97 Cb 0.57 -1.73 -0.13 0.00 -0.04 0.00 0.00 33.50 32.18 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 1.34 -0.90 0.52 3.04 -2.05 -3.30 116.25 114.89 1wfz h VAL 98 Ca 0.00 -3.10 -0.44 0.00 -1.01 0.00 0.00 66.70 62.15 1wfz h VAL 98 Cb 0.31 2.66 -0.26 0.00 -2.01 0.00 0.00 31.29 31.99 1wfz h VAL 98 CO 0.00 0.76 0.53 0.29 -1.01 0.00 0.00 177.57 178.14 1wfz n LYS 99 N -3.22 2.49 -0.14 4.17 4.76 -1.03 -4.53 118.16 120.66 1wfz n LYS 99 Ca -0.07 -3.04 -0.11 0.00 -2.87 0.00 0.00 58.31 52.22 1wfz n LYS 99 Cb 0.98 -2.16 -0.01 0.00 -1.84 0.00 0.00 35.03 32.00 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 1.31 0.73 -0.95 -0.35 3.38 -1.64 -3.02 115.31 114.75 1wfz h LEU 100 Ca 0.54 -0.32 0.38 0.00 0.09 0.00 0.00 57.88 58.57 1wfz h LEU 100 Cb 2.68 -0.20 -0.15 0.00 0.09 0.00 0.00 40.66 43.08 1wfz h LEU 100 CO 0.98 0.88 0.54 0.00 0.09 0.00 0.00 178.44 180.93 1wfz n HIS 101 N -4.41 0.96 0.26 1.13 1.44 -1.26 0.46 115.22 113.80 1wfz n HIS 101 Ca -0.01 0.97 -0.15 0.00 -2.01 0.00 0.00 57.72 56.52 1wfz n HIS 101 Cb 0.31 -1.38 -0.08 0.00 0.12 0.00 0.00 29.99 28.96 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 -0.86 -1.34 -0.78 0.00 0.87 -0.11 0.18 113.55 111.51 1wfz h SER 103 Ca -0.07 0.20 0.08 0.00 -1.23 0.00 0.00 61.79 60.77 1wfz h SER 103 Cb 0.59 0.58 -0.06 0.00 -0.44 0.00 0.00 62.40 63.06 1wfz h SER 103 CO 0.11 -0.17 0.45 0.00 -0.53 0.00 0.00 176.83 176.69 1wfz h MET 104 N -0.06 0.77 -0.96 2.24 -0.00 -1.57 -1.52 114.93 113.83 1wfz h MET 104 Ca 0.09 -0.05 0.20 0.00 -0.00 0.00 0.00 59.70 59.94 1wfz h MET 104 Cb 0.29 -0.17 -0.11 0.00 -0.00 0.00 0.00 31.60 31.60 1wfz h MET 104 CO -0.55 0.51 0.55 1.25 -0.00 0.00 0.00 176.91 178.66 1wfz h LEU 105 N 0.79 0.65 -0.05 -0.10 5.85 0.44 0.34 115.31 123.24 1wfz h LEU 105 Ca 0.36 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 59.19 1wfz h LEU 105 Cb 0.26 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 1wfz h LEU 105 CO -0.21 0.19 0.02 0.00 -0.34 0.00 0.00 178.44 178.10 1wfz h ALA 106 N 1.66 0.06 0.16 1.25 0.00 -0.02 -1.04 119.26 121.33 1wfz h ALA 106 Ca 0.57 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.42 1wfz h ALA 106 Cb 0.95 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1wfz h ALA 106 CO -0.42 -0.40 -0.08 1.49 0.00 0.00 0.00 179.25 179.85 1wfz h GLU 107 N -0.02 -0.21 -0.58 0.00 4.81 -1.06 -2.19 114.58 115.33 1wfz h GLU 107 Ca 0.02 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.36 1wfz h GLU 107 Cb 0.09 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1wfz h GLU 107 CO -0.00 -0.11 0.39 -0.44 -0.73 0.00 0.00 179.01 178.12 1wfz h ASP 108 N -0.25 0.32 0.22 1.04 3.32 -0.95 -2.28 116.42 117.85 1wfz h ASP 108 Ca -0.02 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1wfz h ASP 108 Cb 0.19 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1wfz h ASP 108 CO 0.04 0.19 -0.11 0.00 -1.72 0.00 0.00 179.24 177.64 1wfz h ALA 109 N 1.71 -0.30 0.03 3.45 0.00 -0.66 -2.68 119.26 120.81 1wfz h ALA 109 Ca 0.27 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1wfz h ALA 109 Cb 0.59 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1wfz h ALA 109 CO -0.07 -0.54 -0.27 0.82 0.00 0.00 0.00 179.25 179.20 1wfz h ILE 110 N -0.56 0.00 -0.81 0.00 2.04 -0.84 -2.25 117.51 115.08 1wfz h ILE 110 Ca -0.03 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.94 1wfz h ILE 110 Cb 0.42 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.37 1wfz h ILE 110 CO 0.05 0.00 -0.45 0.11 0.00 0.00 0.00 178.15 177.86 1wfz h LYS 111 N -0.36 -0.10 -0.87 2.37 6.56 -1.58 0.27 116.57 122.86 1wfz h LYS 111 Ca 0.00 0.01 0.22 0.00 -1.06 0.00 0.00 60.65 59.82 1wfz h LYS 111 Cb 0.37 0.02 -0.15 0.00 -0.57 0.00 0.00 32.23 31.90 1wfz h LYS 111 CO -0.16 -0.06 0.05 0.00 -2.06 0.00 0.00 179.45 177.22 1wfz h ALA 112 N 0.87 1.02 -0.21 3.86 0.00 -1.13 0.90 119.26 124.57 1wfz h ALA 112 Ca 0.23 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1wfz h ALA 112 Cb 0.54 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1wfz h ALA 112 CO -0.84 -0.48 0.00 0.00 0.00 0.00 0.00 179.25 177.92 1wfz n ALA 113 N -2.98 -0.34 -0.10 0.00 0.00 0.92 -0.02 120.51 117.98 1wfz n ALA 113 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.52 1wfz n ALA 113 Cb 0.62 0.13 -0.05 0.00 0.00 0.00 0.00 19.45 20.15 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 -1.40 -0.00 0.00 -0.00 -1.17 -1.14 115.31 111.60 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 0.60 -0.01 0.00 -0.00 0.00 0.00 40.66 41.26 1wfz h LEU 114 CO 0.00 -0.38 -0.06 0.00 -0.00 0.00 0.00 178.44 178.00 1wfz h ALA 115 N 0.36 -0.54 -0.95 1.53 0.00 -0.82 -0.04 119.26 118.80 1wfz h ALA 115 Ca 0.12 -0.01 0.35 0.00 0.00 0.00 0.00 54.91 55.37 1wfz h ALA 115 Cb 0.59 0.56 -0.17 0.00 0.00 0.00 0.00 17.79 18.77 1wfz h ALA 115 CO -0.54 -0.56 0.33 -3.47 0.00 0.00 0.00 179.25 175.01 1wfz n ASP 116 N -2.85 0.16 -0.05 0.00 -0.08 0.97 0.10 116.55 114.80 1wfz n ASP 116 Ca -0.01 1.60 -0.11 0.00 -1.51 0.00 0.00 54.79 54.76 1wfz n ASP 116 Cb 0.05 -0.70 -0.05 0.00 2.34 0.00 0.00 41.12 42.75 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 0.29 -0.62 -0.67 3.20 -0.22 -3.00 116.97 115.94 1wfz h TYR 117 Ca 0.72 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.58 1wfz h TYR 117 Cb 1.78 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 39.93 1wfz h TYR 117 CO -0.19 0.37 0.39 0.87 -1.64 0.00 0.00 178.16 177.96 1wfz h LYS 118 N 0.13 0.77 -0.91 1.82 1.57 0.25 -2.31 116.57 117.89 1wfz h LYS 118 Ca 0.06 -0.05 0.22 0.00 -1.87 0.00 0.00 60.65 59.02 1wfz h LYS 118 Cb 0.21 -0.17 -0.12 0.00 0.08 0.00 0.00 32.23 32.22 1wfz h LYS 118 CO -0.00 0.51 0.42 -0.07 -0.57 0.00 0.00 179.45 179.74 1wfz h LEU 119 N 0.79 0.38 -0.56 2.94 3.38 -0.92 0.25 115.31 121.57 1wfz h LEU 119 Ca 0.24 0.15 -0.09 0.00 0.09 0.00 0.00 57.88 58.27 1wfz h LEU 119 Cb -0.03 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1wfz h LEU 119 CO -0.08 0.01 -0.00 0.11 0.09 0.00 0.00 178.44 178.57 1wfz h LYS 120 N 0.43 1.00 -0.24 1.13 1.57 -1.35 -2.83 116.57 116.27 1wfz h LYS 120 Ca 0.57 -0.32 -0.06 0.00 -1.87 0.00 0.00 60.65 58.97 1wfz h LYS 120 Cb 1.09 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1wfz h LYS 120 CO -0.52 0.99 -0.12 1.96 -0.57 0.00 0.00 179.45 181.19 1wfz h GLN 121 N 0.88 0.39 -0.79 3.15 1.08 -0.41 -2.97 115.11 116.44 1wfz h GLN 121 Ca 0.16 -0.10 0.18 0.00 -1.45 0.00 0.00 58.65 57.44 1wfz h GLN 121 Cb 0.55 -0.05 -0.14 0.00 -0.05 0.00 0.00 27.48 27.79 1wfz h GLN 121 CO 0.03 0.52 0.03 0.93 -0.95 0.00 0.00 178.83 179.38 1wfz h GLU 122 N 0.36 0.10 -6.04 1.46 5.08 -0.69 -3.45 114.58 111.40 1wfz h GLU 122 Ca 0.07 -0.01 -0.42 0.00 -1.00 0.00 0.00 59.36 58.00 1wfz h GLU 122 Cb 0.44 -0.02 0.06 0.00 0.50 0.00 0.00 28.75 29.72 1wfz h GLU 122 CO 0.02 0.07 -0.75 0.43 -1.00 0.00 0.00 179.01 177.78 1wfz n SER 123 N -5.35 -4.11 -3.53 1.42 7.64 -1.12 -4.98 113.62 103.58 1wfz n SER 123 Ca 0.15 -0.70 -0.18 0.00 1.01 0.00 0.00 58.87 59.15 1wfz n SER 123 Cb 0.51 -4.42 -0.14 0.00 -1.01 0.00 0.00 64.21 59.16 1wfz n SER 123 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1wfz s LYS 124 N -6.23 0.16 -0.41 1.43 2.20 -1.26 -5.11 119.74 110.52 1wfz s LYS 124 Ca 0.41 0.26 -0.03 0.00 -0.36 0.00 0.00 55.97 56.24 1wfz s LYS 124 Cb -0.20 -1.08 0.11 0.00 -1.51 0.00 0.00 37.83 35.16 1wfz s LYS 124 CO 0.78 -0.59 0.21 -1.12 -0.36 0.00 0.00 175.35 174.28 1wfz s SER 125 N 2.31 5.29 0.43 1.43 0.01 -1.26 -5.09 113.70 116.82 1wfz s SER 125 Ca 0.06 -2.02 0.08 0.00 1.31 0.00 0.00 55.95 55.37 1wfz s SER 125 Cb -0.15 -1.84 0.00 0.00 0.21 0.00 0.00 66.02 64.24 1wfz s SER 125 CO -0.11 -0.56 0.52 -0.83 0.41 0.00 0.00 173.24 172.67 1wfz s GLY 126 N 1.89 2.01 0.17 3.44 0.00 -1.26 -5.08 107.32 108.49 1wfz s GLY 126 Ca 0.08 -1.75 -0.30 0.00 0.00 0.00 0.00 44.72 42.74 1wfz s GLY 126 CO -0.04 -1.57 1.32 2.56 0.00 0.00 0.00 173.10 175.37 1wfz s PRO 127 N -4.29 4.37 -0.80 2.90 0.04 -1.26 -4.99 135.00 130.97 1wfz s PRO 127 Ca 0.53 2.05 -0.02 0.00 0.04 0.00 0.00 61.00 63.60 1wfz s PRO 127 Cb -0.08 -3.21 0.20 0.00 0.04 0.00 0.00 34.50 31.45 1wfz s PRO 127 CO 0.31 -0.30 0.66 0.45 0.04 0.00 0.00 177.00 178.16 1wfz s SER 128 N 0.56 5.70 0.39 6.66 0.15 -1.26 -5.05 113.70 120.84 1wfz s SER 128 Ca 0.59 -3.45 0.08 0.00 0.70 0.00 0.00 55.95 53.87 1wfz s SER 128 Cb -0.36 -1.88 -0.07 0.00 -1.71 0.00 0.00 66.02 61.99 1wfz s SER 128 CO 0.36 -0.24 -0.03 -0.94 1.20 0.00 0.00 173.24 173.59 1wfz s SER 129 N 0.07 3.82 0.00 5.45 1.04 -1.26 -5.36 113.70 117.46 1wfz s SER 129 Ca 0.24 -1.31 0.00 0.00 0.48 0.00 0.00 55.95 55.36 1wfz s SER 129 Cb -0.11 -0.38 0.00 0.00 0.10 0.00 0.00 66.02 65.63 1wfz s SER 129 CO -0.10 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.37