#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wuz n ASN 2 N 0.00 -5.87 -1.18 1.61 3.02 -1.26 -5.00 115.26 106.59 1wuz n ASN 2 Ca 0.00 1.35 0.00 0.00 -0.03 0.00 0.00 54.58 55.90 1wuz n ASN 2 Cb 0.00 -5.03 -0.01 0.00 -0.61 0.00 0.00 39.78 34.14 1wuz n ASN 2 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1wuz n SER 3 N 1.06 0.28 -4.56 6.41 3.41 -1.26 -5.07 113.62 113.89 1wuz n SER 3 Ca -0.12 -1.94 -0.43 0.00 -0.26 0.00 0.00 58.87 56.13 1wuz n SER 3 Cb 0.21 -0.11 -0.04 0.00 -0.26 0.00 0.00 64.21 64.01 1wuz n SER 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wuz s GLN 4 N 0.00 3.49 0.01 4.33 0.00 -1.26 -1.50 119.66 124.72 1wuz s GLN 4 Ca 0.18 0.07 0.04 0.00 -0.00 0.00 0.00 55.36 55.66 1wuz s GLN 4 Cb 0.21 -3.95 -0.01 0.00 0.00 0.00 0.00 33.01 29.26 1wuz s GLN 4 CO -0.09 -1.25 -0.12 0.42 0.00 0.00 0.00 175.29 174.25 1wuz s ILE 5 N 3.73 0.95 0.02 3.63 -1.09 -0.08 -5.02 121.20 123.34 1wuz s ILE 5 Ca 0.35 -0.68 0.00 0.00 -2.23 0.00 0.00 60.65 58.10 1wuz s ILE 5 Cb -0.11 -0.82 -0.02 0.00 -1.58 0.00 0.00 42.46 39.93 1wuz s ILE 5 CO 0.25 0.14 -0.04 -1.38 -1.23 0.00 0.00 174.94 172.69 1wuz s HIS 6 N -0.51 0.32 0.34 3.97 -3.43 -1.26 -1.04 115.29 113.68 1wuz s HIS 6 Ca 0.03 -0.56 0.07 0.00 -0.80 0.00 0.00 55.06 53.80 1wuz s HIS 6 Cb -0.06 -0.23 -0.07 0.00 -1.43 0.00 0.00 32.58 30.80 1wuz s HIS 6 CO 0.00 -0.19 -0.04 0.71 -2.00 0.00 0.00 174.74 173.22 1wuz s TYR 7 N -1.62 2.24 -0.25 0.38 2.02 -0.48 -4.91 117.35 114.72 1wuz s TYR 7 Ca -0.14 -0.66 0.01 0.00 -0.37 0.00 0.00 57.07 55.91 1wuz s TYR 7 Cb -0.09 -1.38 0.04 0.00 -0.40 0.00 0.00 41.96 40.13 1wuz s TYR 7 CO -0.01 0.38 -0.09 -1.12 -1.57 0.00 0.00 175.55 173.14 1wuz s SER 8 N -3.57 4.26 -0.14 2.29 0.01 -0.88 -2.78 113.70 112.90 1wuz s SER 8 Ca 0.33 -1.10 -0.01 0.00 1.31 0.00 0.00 55.95 56.48 1wuz s SER 8 Cb 0.05 -1.60 0.03 0.00 0.21 0.00 0.00 66.02 64.72 1wuz s SER 8 CO 0.15 -0.15 -0.06 -0.51 0.41 0.00 0.00 173.24 173.09 1wuz s ILE 9 N 1.22 1.02 0.30 1.44 2.07 -1.04 -4.55 121.20 121.65 1wuz s ILE 9 Ca -0.03 -0.45 -0.29 0.00 -1.41 0.00 0.00 60.65 58.47 1wuz s ILE 9 Cb -0.18 -1.14 -0.10 0.00 0.13 0.00 0.00 42.46 41.17 1wuz s ILE 9 CO -0.06 0.22 1.24 -2.16 -1.91 0.00 0.00 174.94 172.28 1wuz s PRO 10 N 1.69 4.46 0.85 3.50 0.04 -1.26 -1.76 135.00 142.51 1wuz s PRO 10 Ca 0.03 2.06 -0.15 0.00 0.04 0.00 0.00 61.00 62.97 1wuz s PRO 10 Cb -0.14 -3.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 1wuz s PRO 10 CO -0.08 -0.06 0.22 0.39 0.04 0.00 0.00 177.00 177.51 1wuz n GLU 11 N 1.19 -0.01 -2.79 4.56 1.02 -0.89 -2.81 120.64 120.89 1wuz n GLU 11 Ca 0.00 0.03 -0.19 0.00 -0.02 0.00 0.00 57.16 56.99 1wuz n GLU 11 Cb 0.43 -1.66 0.02 0.00 -0.02 0.00 0.00 31.44 30.21 1wuz n GLU 11 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1wuz n GLU 12 N -0.49 -3.63 -2.42 3.49 2.13 -1.08 -4.93 120.64 113.72 1wuz n GLU 12 Ca 0.06 0.78 -0.43 0.00 0.66 0.00 0.00 57.16 58.24 1wuz n GLU 12 Cb 0.52 -5.32 -0.02 0.00 0.27 0.00 0.00 31.44 26.89 1wuz n GLU 12 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wuz s ALA 13 N -3.04 3.06 1.11 4.31 0.00 -1.12 -4.84 121.76 121.23 1wuz s ALA 13 Ca 0.21 -0.29 -0.19 0.00 0.00 0.00 0.00 51.96 51.69 1wuz s ALA 13 Cb -0.09 -3.94 0.09 0.00 0.00 0.00 0.00 23.12 19.17 1wuz s ALA 13 CO 0.26 -2.40 -0.05 1.63 0.00 0.00 0.00 175.76 175.20 1wuz n LYS 14 N 8.06 -1.45 -2.01 0.00 4.76 -1.26 -4.51 118.16 121.75 1wuz n LYS 14 Ca 0.15 -0.40 -0.43 0.00 -2.87 0.00 0.00 58.31 54.76 1wuz n LYS 14 Cb 0.48 -1.67 -0.03 0.00 -1.84 0.00 0.00 35.03 31.98 1wuz n LYS 14 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 1wuz s HIS 15 N -2.23 1.94 0.00 2.13 3.76 -1.26 -1.94 115.29 117.69 1wuz s HIS 15 Ca 0.55 0.35 0.00 0.00 -0.15 0.00 0.00 55.06 55.81 1wuz s HIS 15 Cb -0.11 -3.96 0.00 0.00 1.11 0.00 0.00 32.58 29.62 1wuz s HIS 15 CO 0.66 -3.54 0.00 0.41 -0.85 0.00 0.00 174.74 171.42 1wuz n GLY 16 N 4.51 0.87 3.77 -2.22 0.00 -0.70 -4.93 105.19 106.49 1wuz n GLY 16 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 1wuz n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wuz s THR 17 N -2.05 2.53 0.36 2.61 2.01 -0.82 -4.39 115.64 115.90 1wuz s THR 17 Ca 0.00 0.46 -0.28 0.00 0.31 0.00 0.00 61.69 62.17 1wuz s THR 17 Cb 0.00 -3.26 -0.11 0.00 0.01 0.00 0.00 72.50 69.14 1wuz s THR 17 CO 0.00 0.05 1.43 0.12 -0.69 0.00 0.00 174.62 175.53 1wuz s PHE 18 N -1.30 2.74 0.00 4.92 2.19 -1.26 -1.65 117.98 123.61 1wuz s PHE 18 Ca 0.60 1.25 0.00 0.00 0.33 0.00 0.00 56.93 59.11 1wuz s PHE 18 Cb -0.38 -3.91 0.00 0.00 -1.31 0.00 0.00 43.02 37.42 1wuz s PHE 18 CO 0.48 -2.62 0.00 0.28 1.83 0.00 0.00 175.22 175.19 1wuz n VAL 19 N 0.56 0.00 -3.09 3.12 0.31 0.30 -4.77 118.33 114.76 1wuz n VAL 19 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1wuz n VAL 19 Cb 0.40 -1.11 0.00 0.00 -0.91 0.00 0.00 33.84 32.22 1wuz n VAL 19 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wuz n GLY 20 N 2.67 -1.02 2.91 2.92 0.00 -1.20 -2.06 105.19 109.41 1wuz n GLY 20 Ca 0.00 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 1wuz n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wuz n ARG 21 N 0.00 2.60 -0.26 1.61 1.74 -1.26 -0.15 116.66 120.93 1wuz n ARG 21 Ca 0.00 -4.53 0.05 0.00 -0.77 0.00 0.00 57.85 52.60 1wuz n ARG 21 Cb 0.00 -2.36 0.19 0.00 -1.02 0.00 0.00 32.46 29.27 1wuz n ARG 21 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1wuz h ILE 22 N 3.88 0.69 0.12 0.55 2.10 -1.84 0.22 117.51 123.23 1wuz h ILE 22 Ca 0.17 -0.17 -0.01 0.00 1.08 0.00 0.00 64.86 65.94 1wuz h ILE 22 Cb 0.75 0.15 0.00 0.00 -1.09 0.00 0.00 36.82 36.63 1wuz h ILE 22 CO 0.87 0.09 -0.06 0.00 -1.08 0.00 0.00 178.15 177.97 1wuz h ALA 23 N 1.54 -0.16 -1.00 0.18 0.00 -1.70 -0.81 119.26 117.31 1wuz h ALA 23 Ca 0.42 -0.23 0.14 0.00 0.00 0.00 0.00 54.91 55.24 1wuz h ALA 23 Cb 0.61 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.37 1wuz h ALA 23 CO -0.38 -0.34 0.62 0.37 0.00 0.00 0.00 179.25 179.51 1wuz h GLN 24 N -0.65 0.88 0.00 0.00 5.75 -1.63 0.34 115.11 119.80 1wuz h GLN 24 Ca -0.02 -0.05 -0.12 0.00 -0.15 0.00 0.00 58.65 58.31 1wuz h GLN 24 Cb 0.50 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.84 1wuz h GLN 24 CO 0.03 0.58 -0.59 -0.44 -2.65 0.00 0.00 178.83 175.76 1wuz h ASP 25 N 0.91 0.00 0.04 -0.69 3.32 -0.59 -3.23 116.42 116.18 1wuz h ASP 25 Ca 0.52 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 57.30 1wuz h ASP 25 Cb 0.62 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.19 1wuz h ASP 25 CO -0.31 0.59 -1.06 -0.07 -1.72 0.00 0.00 179.24 176.68 1wuz h LEU 26 N 0.00 0.88 -0.37 1.55 4.07 0.70 -3.49 115.31 118.65 1wuz h LEU 26 Ca -0.01 -0.72 0.00 0.00 0.08 0.00 0.00 57.88 57.24 1wuz h LEU 26 Cb 1.25 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.71 1wuz h LEU 26 CO 0.08 1.52 0.00 0.61 -1.08 0.00 0.00 178.44 179.57 1wuz n GLY 27 N 1.10 0.92 3.19 0.83 0.00 0.94 -5.08 105.19 107.10 1wuz n GLY 27 Ca -0.11 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 1wuz n GLY 27 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1wuz s LEU 28 N -0.37 2.47 0.12 0.99 0.05 -1.21 -5.08 118.68 115.64 1wuz s LEU 28 Ca 0.00 -0.92 -0.14 0.00 0.05 0.00 0.00 54.13 53.12 1wuz s LEU 28 Cb 0.00 -0.23 -0.07 0.00 -2.05 0.00 0.00 46.19 43.84 1wuz s LEU 28 CO 0.00 -0.35 0.50 -1.61 -0.55 0.00 0.00 176.35 174.35 1wuz s GLU 29 N -3.36 3.94 0.58 1.48 0.41 -1.26 -4.69 118.70 115.79 1wuz s GLU 29 Ca 0.10 0.42 0.27 0.00 -0.41 0.00 0.00 54.97 55.36 1wuz s GLU 29 Cb 0.01 -2.99 1.69 0.00 -1.78 0.00 0.00 34.13 31.07 1wuz s GLU 29 CO -0.01 0.52 2.20 -0.07 -0.49 0.00 0.00 175.26 177.41 1wuz h LEU 30 N 3.73 0.00 -0.43 1.80 3.38 -1.98 0.22 115.31 122.03 1wuz h LEU 30 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1wuz h LEU 30 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1wuz h LEU 30 CO 0.65 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.53 1wuz n THR 31 N -3.97 0.06 0.06 0.22 -2.24 -1.26 -3.34 114.28 103.81 1wuz n THR 31 Ca -0.02 -0.13 0.02 0.00 -2.27 0.00 0.00 64.05 61.66 1wuz n THR 31 Cb 0.14 -0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.29 1wuz n THR 31 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1wuz n GLU 32 N -0.39 1.64 -0.15 -0.78 -0.58 0.73 -4.65 120.64 116.46 1wuz n GLU 32 Ca 0.17 -0.03 -0.11 0.00 -0.42 0.00 0.00 57.16 56.77 1wuz n GLU 32 Cb 0.18 -1.00 -0.01 0.00 -0.57 0.00 0.00 31.44 30.04 1wuz n GLU 32 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1wuz h LEU 33 N 0.00 0.77 0.18 -4.62 4.07 -1.44 -1.21 115.31 113.06 1wuz h LEU 33 Ca 0.00 -0.33 0.01 0.00 0.08 0.00 0.00 57.88 57.64 1wuz h LEU 33 Cb 0.19 -0.21 -0.04 0.00 1.08 0.00 0.00 40.66 41.68 1wuz h LEU 33 CO 0.00 0.91 -0.44 0.58 -1.08 0.00 0.00 178.44 178.41 1wuz h VAL 34 N 0.61 0.12 0.00 1.22 2.07 -1.83 -1.40 116.25 117.04 1wuz h VAL 34 Ca 0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1wuz h VAL 34 Cb 0.54 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1wuz h VAL 34 CO 0.03 0.00 0.00 1.55 0.02 0.00 0.00 177.57 179.17 1wuz h PRO 35 N -0.72 0.00 -0.32 1.57 0.13 -1.83 -2.43 132.00 128.40 1wuz h PRO 35 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1wuz h PRO 35 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1wuz h PRO 35 CO -0.22 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.09 1wuz n ARG 36 N -2.46 1.77 -3.87 0.86 1.74 -0.46 -4.93 116.66 109.31 1wuz n ARG 36 Ca 0.02 -1.19 -0.32 0.00 -0.77 0.00 0.00 57.85 55.58 1wuz n ARG 36 Cb 0.24 -1.27 0.01 0.00 -1.02 0.00 0.00 32.46 30.42 1wuz n ARG 36 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1wuz n LEU 37 N 0.46 -2.13 -4.77 0.55 7.99 -0.91 -1.74 117.00 116.46 1wuz n LEU 37 Ca 0.12 -1.07 -0.41 0.00 -0.01 0.00 0.00 56.01 54.64 1wuz n LEU 37 Cb 0.29 -2.17 -0.02 0.00 -0.11 0.00 0.00 43.42 41.40 1wuz n LEU 37 CO 0.08 0.52 0.95 0.12 -1.51 0.00 0.00 177.39 177.55 1wuz s PHE 38 N -3.68 3.12 0.04 -1.77 5.36 -0.99 -2.68 117.98 117.38 1wuz s PHE 38 Ca 0.30 1.46 -0.22 0.00 -0.96 0.00 0.00 56.93 57.51 1wuz s PHE 38 Cb -0.12 -3.62 0.05 0.00 -0.34 0.00 0.00 43.02 38.99 1wuz s PHE 38 CO 0.89 -1.66 0.50 0.50 -1.46 0.00 0.00 175.22 173.99 1wuz s ARG 39 N -1.76 1.01 0.02 10.12 3.52 0.57 -4.99 118.95 127.44 1wuz s ARG 39 Ca 0.49 -0.25 0.05 0.00 -0.13 0.00 0.00 55.73 55.88 1wuz s ARG 39 Cb -0.38 0.46 -0.02 0.00 -1.56 0.00 0.00 34.95 33.45 1wuz s ARG 39 CO 0.51 -0.36 -0.14 0.08 -0.81 0.00 0.00 175.30 174.58 1wuz s VAL 40 N -2.40 1.08 0.32 7.11 1.01 -1.26 -0.32 120.40 125.93 1wuz s VAL 40 Ca -0.06 -0.87 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 1wuz s VAL 40 Cb -0.01 -0.96 0.05 0.00 0.00 0.00 0.00 36.38 35.46 1wuz s VAL 40 CO -0.01 0.08 0.81 0.00 0.00 0.00 0.00 175.10 175.98 1wuz s ALA 41 N -0.70 -1.03 0.09 5.51 0.00 -0.84 -4.89 121.76 119.91 1wuz s ALA 41 Ca 0.02 -0.53 -0.17 0.00 0.00 0.00 0.00 51.96 51.28 1wuz s ALA 41 Cb -0.07 0.73 0.04 0.00 0.00 0.00 0.00 23.12 23.81 1wuz s ALA 41 CO 0.01 -1.01 0.42 -1.54 0.00 0.00 0.00 175.76 173.63 1wuz s SER 42 N -3.06 -0.28 0.21 0.00 1.04 -1.26 -1.93 113.70 108.42 1wuz s SER 42 Ca 0.15 -0.16 0.16 0.00 0.48 0.00 0.00 55.95 56.58 1wuz s SER 42 Cb -0.05 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.54 1wuz s SER 42 CO 0.09 -0.78 1.23 0.11 0.98 0.00 0.00 173.24 174.87 1wuz h LYS 43 N 2.62 0.00 0.00 4.02 1.57 -1.97 -3.14 116.57 119.68 1wuz h LYS 43 Ca -0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1wuz h LYS 43 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1wuz h LYS 43 CO 0.45 0.39 0.00 -0.25 -0.57 0.00 0.00 179.45 179.47 1wuz n ASP 44 N -3.09 0.00 0.00 0.86 8.00 -1.26 -4.74 116.55 116.32 1wuz n ASP 44 Ca -0.02 0.43 0.00 0.00 0.71 0.00 0.00 54.79 55.91 1wuz n ASP 44 Cb 0.75 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.76 1wuz n ASP 44 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1wuz n ARG 45 N -0.78 1.25 -0.94 -1.24 3.00 -1.26 -5.01 116.66 111.68 1wuz n ARG 45 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1wuz n ARG 45 Cb 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 32.46 31.56 1wuz n ARG 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1wuz n GLY 46 N 2.17 0.83 2.26 5.14 0.00 -1.18 -4.90 105.19 109.52 1wuz n GLY 46 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1wuz n GLY 46 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wuz n ASP 47 N -0.01 1.06 -0.11 1.61 -0.08 -1.26 -4.33 116.55 113.42 1wuz n ASP 47 Ca 0.00 -2.92 -0.20 0.00 -1.51 0.00 0.00 54.79 50.16 1wuz n ASP 47 Cb 0.01 -0.64 -0.09 0.00 2.34 0.00 0.00 41.12 42.74 1wuz n ASP 47 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1wuz n LEU 48 N 1.01 2.33 0.00 -2.67 4.77 -1.26 -4.41 117.00 116.76 1wuz n LEU 48 Ca 0.24 0.08 -0.08 0.00 -0.03 0.00 0.00 56.01 56.22 1wuz n LEU 48 Cb 0.53 -0.73 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 1wuz n LEU 48 CO 0.23 0.68 0.26 0.18 -1.33 0.00 0.00 177.39 177.41 1wuz n LEU 49 N -3.59 0.00 -3.61 2.23 4.32 -1.26 -2.36 117.00 112.73 1wuz n LEU 49 Ca -0.42 -1.86 -0.15 0.00 -0.02 0.00 0.00 56.01 53.56 1wuz n LEU 49 Cb 0.87 2.26 -0.06 0.00 -1.62 0.00 0.00 43.42 44.87 1wuz n LEU 49 CO 0.12 -0.53 0.26 -1.61 -1.22 0.00 0.00 177.39 174.41 1wuz s GLU 50 N -2.27 0.96 -0.07 3.23 0.41 -1.08 -4.77 118.70 115.11 1wuz s GLU 50 Ca 0.15 -0.11 -0.09 0.00 -0.41 0.00 0.00 54.97 54.51 1wuz s GLU 50 Cb -0.02 0.44 -0.05 0.00 -1.78 0.00 0.00 34.13 32.72 1wuz s GLU 50 CO 0.11 -0.32 0.22 0.54 -0.49 0.00 0.00 175.26 175.33 1wuz s VAL 51 N -1.90 5.36 -0.27 2.63 0.11 -1.26 -1.86 120.40 123.21 1wuz s VAL 51 Ca -0.08 0.35 -0.06 0.00 -2.93 0.00 0.00 61.98 59.25 1wuz s VAL 51 Cb -0.01 -3.50 -0.00 0.00 -1.53 0.00 0.00 36.38 31.33 1wuz s VAL 51 CO 0.02 0.57 0.05 0.21 -3.33 0.00 0.00 175.10 172.63 1wuz s ASN 52 N -1.15 4.97 0.35 3.54 3.04 -0.68 -4.96 114.94 120.05 1wuz s ASN 52 Ca 0.19 -0.51 0.25 0.00 0.04 0.00 0.00 52.86 52.83 1wuz s ASN 52 Cb -0.13 -1.86 1.27 0.00 -1.54 0.00 0.00 41.25 38.99 1wuz s ASN 52 CO 0.08 -0.11 1.76 -0.07 -3.04 0.00 0.00 177.10 175.71 1wuz h LEU 53 N 8.21 0.00 -0.52 3.21 4.07 -1.94 0.29 115.31 128.63 1wuz h LEU 53 Ca -0.35 0.00 0.10 0.00 0.08 0.00 0.00 57.88 57.71 1wuz h LEU 53 Cb 1.15 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 42.80 1wuz h LEU 53 CO 0.60 0.00 0.02 1.56 -1.08 0.00 0.00 178.44 179.53 1wuz h GLN 54 N 0.00 0.13 0.00 1.13 7.50 -1.94 -3.31 115.11 118.62 1wuz h GLN 54 Ca 0.00 -0.01 -0.02 0.00 0.50 0.00 0.00 58.65 59.12 1wuz h GLN 54 Cb 0.09 -0.03 -0.04 0.00 0.05 0.00 0.00 27.48 27.54 1wuz h GLN 54 CO 0.00 0.09 -0.48 -1.71 -1.50 0.00 0.00 178.83 175.23 1wuz n ASN 55 N -5.22 0.08 -1.55 1.46 5.15 -1.08 -4.98 115.26 109.12 1wuz n ASN 55 Ca 0.06 -1.85 -0.17 0.00 -0.60 0.00 0.00 54.58 52.02 1wuz n ASN 55 Cb 0.28 -0.17 -0.07 0.00 -0.53 0.00 0.00 39.78 39.29 1wuz n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wuz n GLY 56 N 0.05 1.47 3.85 8.20 0.00 0.99 -4.87 105.19 114.89 1wuz n GLY 56 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1wuz n GLY 56 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wuz s ILE 57 N -2.46 4.86 -0.29 -0.61 -1.09 -1.17 -1.77 121.20 118.67 1wuz s ILE 57 Ca 0.00 0.77 -0.17 0.00 -2.23 0.00 0.00 60.65 59.02 1wuz s ILE 57 Cb 0.00 -3.71 -0.02 0.00 -1.58 0.00 0.00 42.46 37.15 1wuz s ILE 57 CO 0.00 0.17 0.48 -0.22 -1.23 0.00 0.00 174.94 174.13 1wuz s LEU 58 N -2.16 4.13 0.35 2.97 1.98 0.78 -1.69 118.68 125.05 1wuz s LEU 58 Ca 0.40 0.31 0.08 0.00 -2.89 0.00 0.00 54.13 52.03 1wuz s LEU 58 Cb -0.14 -2.58 -0.03 0.00 0.66 0.00 0.00 46.19 44.10 1wuz s LEU 58 CO 0.20 -0.31 0.27 0.72 -1.89 0.00 0.00 176.35 175.33 1wuz s PHE 59 N 2.27 2.83 0.32 5.38 -0.71 -0.78 -0.54 117.98 126.75 1wuz s PHE 59 Ca 0.19 -0.35 -0.26 0.00 -1.04 0.00 0.00 56.93 55.46 1wuz s PHE 59 Cb -0.16 -1.81 -0.10 0.00 -1.21 0.00 0.00 43.02 39.74 1wuz s PHE 59 CO 0.10 0.18 0.97 0.08 -1.34 0.00 0.00 175.22 175.21 1wuz s VAL 60 N -2.36 4.09 -0.29 -2.49 1.01 -0.66 -2.62 120.40 117.08 1wuz s VAL 60 Ca 0.41 1.77 0.19 0.00 0.00 0.00 0.00 61.98 64.35 1wuz s VAL 60 Cb -0.05 -4.00 0.47 0.00 0.00 0.00 0.00 36.38 32.81 1wuz s VAL 60 CO 0.26 0.17 1.26 -3.20 0.00 0.00 0.00 175.10 173.59 1wuz n ASN 61 N 0.61 0.43 -0.94 3.32 2.85 -1.00 -1.72 115.26 118.82 1wuz n ASN 61 Ca 0.02 -2.14 0.00 0.00 -0.11 0.00 0.00 54.58 52.35 1wuz n ASN 61 Cb 0.49 -0.04 0.00 0.00 1.24 0.00 0.00 39.78 41.47 1wuz n ASN 61 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 1wuz n SER 62 N -0.89 0.00 -4.62 1.20 2.88 -1.06 -4.24 113.62 106.89 1wuz n SER 62 Ca -0.02 -0.94 -0.42 0.00 -1.33 0.00 0.00 58.87 56.16 1wuz n SER 62 Cb 0.83 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.25 1wuz n SER 62 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1wuz s ARG 63 N -1.82 3.94 -0.01 -1.46 3.00 -1.26 -4.84 118.95 116.50 1wuz s ARG 63 Ca 0.00 0.70 0.13 0.00 0.00 0.00 0.00 55.73 56.55 1wuz s ARG 63 Cb 0.00 -3.76 -0.18 0.00 0.00 0.00 0.00 34.95 31.01 1wuz s ARG 63 CO 0.00 -0.83 0.34 -0.89 0.00 0.00 0.00 175.30 173.92 1wuz n ILE 64 N 5.77 0.00 -1.49 1.52 2.08 -1.26 -4.13 119.36 121.85 1wuz n ILE 64 Ca 0.07 -0.27 -0.44 0.00 0.56 0.00 0.00 62.75 62.67 1wuz n ILE 64 Cb 0.48 0.41 -0.01 0.00 -0.75 0.00 0.00 39.64 39.77 1wuz n ILE 64 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1wuz n ASP 65 N -1.77 -0.18 0.24 4.38 2.03 -1.26 -2.62 116.55 117.36 1wuz n ASP 65 Ca -0.01 1.04 0.18 0.00 0.52 0.00 0.00 54.79 56.52 1wuz n ASP 65 Cb 0.29 -1.15 0.88 0.00 -0.72 0.00 0.00 41.12 40.42 1wuz n ASP 65 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1wuz h ARG 66 N 1.24 0.00 -0.04 -0.67 -0.00 -1.94 0.39 114.38 113.36 1wuz h ARG 66 Ca -0.38 0.00 -0.22 0.00 -0.50 0.00 0.00 59.98 58.88 1wuz h ARG 66 Cb 1.39 0.00 0.02 0.00 0.00 0.00 0.00 29.97 31.37 1wuz h ARG 66 CO 0.56 0.00 -0.82 1.49 0.00 0.00 0.00 179.97 181.19 1wuz h GLU 67 N 0.00 0.63 0.00 0.04 4.81 -1.87 0.26 114.58 118.46 1wuz h GLU 67 Ca 0.06 -0.62 -0.02 0.00 -0.13 0.00 0.00 59.36 58.65 1wuz h GLU 67 Cb 0.43 0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 1wuz h GLU 67 CO -0.00 1.23 -0.17 0.93 -0.73 0.00 0.00 179.01 180.27 1wuz h GLU 68 N 0.27 0.00 0.00 1.92 3.07 -1.49 -3.41 114.58 114.94 1wuz h GLU 68 Ca -0.09 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.77 1wuz h GLU 68 Cb 1.49 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.40 1wuz h GLU 68 CO 0.16 0.33 0.00 1.28 -1.40 0.00 0.00 179.01 179.38 1wuz n LEU 69 N -4.69 0.00 0.07 1.33 4.77 0.12 -4.92 117.00 113.68 1wuz n LEU 69 Ca -0.06 0.76 0.00 0.00 -0.03 0.00 0.00 56.01 56.68 1wuz n LEU 69 Cb 0.21 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 1wuz n LEU 69 CO 0.12 -0.26 0.00 0.00 -1.33 0.00 0.00 177.39 175.92 1wuz n GLY 71 N -1.47 1.49 0.00 0.00 0.00 0.92 -4.52 105.19 101.61 1wuz n GLY 71 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1wuz n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wuz n ARG 72 N 0.00 0.00 -1.49 1.61 5.12 -1.26 -4.33 116.66 116.31 1wuz n ARG 72 Ca 0.00 0.72 -0.44 0.00 -1.93 0.00 0.00 57.85 56.20 1wuz n ARG 72 Cb 0.00 -1.48 -0.07 0.00 -1.16 0.00 0.00 32.46 29.74 1wuz n ARG 72 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1wuz n SER 73 N -2.42 1.89 -0.23 0.55 7.64 -1.26 -4.80 113.62 114.99 1wuz n SER 73 Ca 0.00 0.10 0.03 0.00 1.01 0.00 0.00 58.87 60.01 1wuz n SER 73 Cb 0.00 -1.30 0.14 0.00 -1.01 0.00 0.00 64.21 62.04 1wuz n SER 73 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wuz h ALA 74 N 14.49 0.85 -2.80 -0.43 0.00 -1.99 -3.34 119.26 126.04 1wuz h ALA 74 Ca -0.23 0.14 -0.71 0.00 0.00 0.00 0.00 54.91 54.10 1wuz h ALA 74 Cb 1.30 0.17 -0.28 0.00 0.00 0.00 0.00 17.79 18.98 1wuz h ALA 74 CO 1.12 -0.29 -0.48 -1.83 0.00 0.00 0.00 179.25 177.78 1wuz s GLU 75 N -6.07 2.62 -0.18 0.00 -1.05 -1.26 -4.91 118.70 107.85 1wuz s GLU 75 Ca -0.13 -1.42 -0.03 0.00 -0.15 0.00 0.00 54.97 53.25 1wuz s GLU 75 Cb 0.19 -3.77 -0.02 0.00 -0.44 0.00 0.00 34.13 30.10 1wuz s GLU 75 CO 0.75 -0.92 -0.06 0.00 0.95 0.00 0.00 175.26 175.97 1wuz s SER 77 N 0.87 4.85 -0.02 0.00 0.01 -1.26 -2.61 113.70 115.54 1wuz s SER 77 Ca -0.01 -0.07 0.05 0.00 1.31 0.00 0.00 55.95 57.22 1wuz s SER 77 Cb -0.15 -1.20 -0.01 0.00 0.21 0.00 0.00 66.02 64.87 1wuz s SER 77 CO 0.01 0.29 -0.18 -0.63 0.41 0.00 0.00 173.24 173.14 1wuz s ILE 78 N -1.02 1.42 -0.02 1.44 1.09 -0.75 -5.02 121.20 118.34 1wuz s ILE 78 Ca 0.18 -0.76 0.05 0.00 -1.10 0.00 0.00 60.65 59.02 1wuz s ILE 78 Cb -0.11 -1.19 -0.03 0.00 -1.06 0.00 0.00 42.46 40.07 1wuz s ILE 78 CO 0.08 0.40 -0.15 -1.00 -0.10 0.00 0.00 174.94 174.18 1wuz s HIS 79 N -0.31 2.67 0.05 3.97 3.76 -1.26 -1.95 115.29 122.22 1wuz s HIS 79 Ca 0.04 -0.18 -0.07 0.00 -0.15 0.00 0.00 55.06 54.71 1wuz s HIS 79 Cb -0.08 -1.58 -0.01 0.00 1.11 0.00 0.00 32.58 32.03 1wuz s HIS 79 CO -0.00 0.22 0.12 -1.17 -0.85 0.00 0.00 174.74 173.06 1wuz s LEU 80 N -1.01 1.69 -0.11 0.89 0.20 0.86 -4.79 118.68 116.41 1wuz s LEU 80 Ca 0.13 -0.55 -0.01 0.00 0.69 0.00 0.00 54.13 54.39 1wuz s LEU 80 Cb -0.11 0.73 0.03 0.00 -0.43 0.00 0.00 46.19 46.41 1wuz s LEU 80 CO 0.03 -0.56 -0.05 -1.61 -0.29 0.00 0.00 176.35 173.86 1wuz s GLU 81 N -2.92 1.22 -0.47 1.98 8.01 -0.81 -2.02 118.70 123.69 1wuz s GLU 81 Ca -0.02 -0.19 -0.21 0.00 0.01 0.00 0.00 54.97 54.56 1wuz s GLU 81 Cb 0.01 -1.49 0.03 0.00 -4.31 0.00 0.00 34.13 28.37 1wuz s GLU 81 CO -0.06 -0.31 0.68 0.08 0.01 0.00 0.00 175.26 175.66 1wuz s VAL 82 N 1.78 4.78 -0.26 2.63 1.01 -1.08 -1.98 120.40 127.27 1wuz s VAL 82 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 61.74 1wuz s VAL 82 Cb -0.13 -4.27 0.01 0.00 0.00 0.00 0.00 36.38 31.99 1wuz s VAL 82 CO -0.07 -0.71 1.04 -0.63 0.00 0.00 0.00 175.10 174.73 1wuz s ILE 83 N 2.93 4.63 -0.07 2.22 1.09 0.56 -2.10 121.20 130.47 1wuz s ILE 83 Ca 0.22 1.92 0.04 0.00 -1.10 0.00 0.00 60.65 61.73 1wuz s ILE 83 Cb -0.15 -4.34 0.00 0.00 -1.06 0.00 0.00 42.46 36.92 1wuz s ILE 83 CO 0.18 -0.27 -0.18 0.68 -0.10 0.00 0.00 174.94 175.24 1wuz s VAL 84 N 3.33 1.59 -0.28 2.92 -7.23 -0.91 -0.31 120.40 119.50 1wuz s VAL 84 Ca 0.44 -0.77 -0.10 0.00 -1.81 0.00 0.00 61.98 59.74 1wuz s VAL 84 Cb -0.14 -1.38 -0.03 0.00 0.56 0.00 0.00 36.38 35.39 1wuz s VAL 84 CO 0.09 0.45 0.14 -0.62 -0.31 0.00 0.00 175.10 174.86 1wuz s ASP 85 N 0.27 5.60 -0.21 4.85 2.15 -0.71 -2.55 116.67 126.07 1wuz s ASP 85 Ca -0.11 -0.24 -0.04 0.00 0.43 0.00 0.00 52.55 52.59 1wuz s ASP 85 Cb -0.15 -2.03 0.01 0.00 -0.30 0.00 0.00 42.92 40.45 1wuz s ASP 85 CO 0.05 -0.10 0.16 -1.14 -0.17 0.00 0.00 175.17 173.97 1wuz n ARG 86 N 5.00 -1.75 -1.37 4.34 0.00 -1.26 -3.79 116.66 117.83 1wuz n ARG 86 Ca -0.15 1.66 -0.31 0.00 -0.00 0.00 0.00 57.85 59.05 1wuz n ARG 86 Cb 0.51 -3.74 0.08 0.00 0.00 0.00 0.00 32.46 29.31 1wuz n ARG 86 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1wuz s PRO 87 N -1.41 2.37 -0.62 -0.14 0.04 -1.26 -4.63 135.00 129.35 1wuz s PRO 87 Ca 0.07 1.22 -0.21 0.00 0.04 0.00 0.00 61.00 62.11 1wuz s PRO 87 Cb -0.02 -1.91 0.07 0.00 0.04 0.00 0.00 34.50 32.69 1wuz s PRO 87 CO 0.45 -1.56 0.87 -0.51 0.04 0.00 0.00 177.00 176.29 1wuz s LEU 88 N -5.69 4.67 0.00 -3.56 1.02 -1.26 -4.70 118.68 109.16 1wuz s LEU 88 Ca 0.62 -1.03 -0.14 0.00 0.02 0.00 0.00 54.13 53.60 1wuz s LEU 88 Cb -0.18 -2.43 0.05 0.00 0.02 0.00 0.00 46.19 43.65 1wuz s LEU 88 CO 0.53 -1.29 0.66 0.00 0.02 0.00 0.00 176.35 176.27 1wuz n GLN 89 N 7.20 0.27 -4.27 1.70 10.64 -1.06 -5.06 117.38 126.80 1wuz n GLN 89 Ca -0.05 -0.71 -0.18 0.00 -1.83 0.00 0.00 57.00 54.23 1wuz n GLN 89 Cb 0.45 1.01 -0.11 0.00 -0.86 0.00 0.00 30.24 30.73 1wuz n GLN 89 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1wuz s VAL 90 N -2.20 1.46 -0.18 -0.39 1.01 -1.26 -2.14 120.40 116.70 1wuz s VAL 90 Ca 0.15 -1.85 -0.03 0.00 0.00 0.00 0.00 61.98 60.25 1wuz s VAL 90 Cb -0.01 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.67 1wuz s VAL 90 CO 0.02 -0.45 -0.06 -0.36 0.00 0.00 0.00 175.10 174.25 1wuz s PHE 91 N -2.33 2.94 -0.19 5.22 0.08 -0.89 -4.91 117.98 117.90 1wuz s PHE 91 Ca 0.13 -0.67 -0.29 0.00 0.12 0.00 0.00 56.93 56.22 1wuz s PHE 91 Cb -0.04 -2.00 -0.03 0.00 -0.57 0.00 0.00 43.02 40.38 1wuz s PHE 91 CO 0.04 -0.31 1.60 -1.58 -0.10 0.00 0.00 175.22 174.87 1wuz s HIS 92 N 0.87 2.14 -0.10 0.36 2.46 -0.56 -2.64 115.29 117.81 1wuz s HIS 92 Ca -0.01 0.52 0.03 0.00 0.47 0.00 0.00 55.06 56.06 1wuz s HIS 92 Cb -0.15 -3.94 0.01 0.00 -0.13 0.00 0.00 32.58 28.37 1wuz s HIS 92 CO 0.01 -3.00 -0.19 0.08 -2.47 0.00 0.00 174.74 169.17 1wuz s VAL 93 N 4.90 1.74 -0.16 0.89 1.01 -0.86 -0.91 120.40 127.02 1wuz s VAL 93 Ca 0.71 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 1wuz s VAL 93 Cb -0.26 -1.54 0.05 0.00 0.00 0.00 0.00 36.38 34.63 1wuz s VAL 93 CO 0.28 0.49 0.04 -1.61 0.00 0.00 0.00 175.10 174.30 1wuz s GLU 94 N 0.68 0.48 -0.19 2.72 2.02 -0.21 -0.10 118.70 124.10 1wuz s GLU 94 Ca -0.12 -0.20 -0.05 0.00 0.02 0.00 0.00 54.97 54.61 1wuz s GLU 94 Cb -0.16 -1.75 -0.03 0.00 0.10 0.00 0.00 34.13 32.29 1wuz s GLU 94 CO 0.03 -0.57 0.00 0.14 0.02 0.00 0.00 175.26 174.89 1wuz s VAL 95 N 1.96 4.09 0.08 2.63 -7.23 -0.82 -1.39 120.40 119.72 1wuz s VAL 95 Ca 0.01 -0.27 0.03 0.00 -1.81 0.00 0.00 61.98 59.93 1wuz s VAL 95 Cb -0.16 -2.84 -0.04 0.00 0.56 0.00 0.00 36.38 33.91 1wuz s VAL 95 CO -0.07 0.45 0.11 -0.70 -0.31 0.00 0.00 175.10 174.57 1wuz s GLU 96 N 0.75 2.98 0.26 4.82 -6.30 -1.12 -1.82 118.70 118.28 1wuz s GLU 96 Ca 0.00 -0.66 -0.28 0.00 -2.50 0.00 0.00 54.97 51.54 1wuz s GLU 96 Cb -0.14 -2.78 -0.09 0.00 0.00 0.00 0.00 34.13 31.12 1wuz s GLU 96 CO 0.02 0.57 0.91 0.14 0.02 0.00 0.00 175.26 176.92 1wuz s VAL 97 N -1.43 4.17 -0.32 3.70 -7.23 -1.07 -2.51 120.40 115.71 1wuz s VAL 97 Ca 0.30 1.93 0.04 0.00 -1.81 0.00 0.00 61.98 62.44 1wuz s VAL 97 Cb -0.12 -4.18 0.09 0.00 0.56 0.00 0.00 36.38 32.72 1wuz s VAL 97 CO 0.23 0.37 0.00 -0.60 -0.31 0.00 0.00 175.10 174.80 1wuz s ARG 98 N -1.50 1.72 0.00 4.82 3.00 -0.73 -4.80 118.95 121.46 1wuz s ARG 98 Ca 0.43 -1.72 0.00 0.00 -1.00 0.00 0.00 55.73 53.45 1wuz s ARG 98 Cb -0.23 -3.12 0.00 0.00 0.00 0.00 0.00 34.95 31.61 1wuz s ARG 98 CO 0.28 -0.83 0.00 -3.47 0.00 0.00 0.00 175.30 171.28 1wuz n ASP 99 N 4.31 0.00 -4.22 -2.12 -0.08 -1.26 -2.10 116.55 111.08 1wuz n ASP 99 Ca -0.02 0.00 -0.16 0.00 -1.51 0.00 0.00 54.79 53.10 1wuz n ASP 99 Cb 0.42 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.77 1wuz n ASP 99 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1wuz s ILE 100 N -3.00 1.17 -0.05 5.18 1.10 -1.26 -5.04 121.20 119.30 1wuz s ILE 100 Ca 0.00 -1.75 -0.04 0.00 -0.51 0.00 0.00 60.65 58.35 1wuz s ILE 100 Cb 0.00 -1.53 -0.02 0.00 0.15 0.00 0.00 42.46 41.06 1wuz s ILE 100 CO 0.00 -0.52 0.22 -1.13 -2.11 0.00 0.00 174.94 171.40 1wuz h ASN 101 N 3.40 -0.12 0.00 4.50 -1.24 -1.91 -3.44 115.58 116.76 1wuz h ASN 101 Ca -0.38 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.63 1wuz h ASN 101 Cb 1.19 0.03 0.00 0.00 0.73 0.00 0.00 38.32 40.27 1wuz h ASN 101 CO 0.54 0.18 -0.81 -0.67 -1.29 0.00 0.00 177.43 175.38 1wuz n ASP 102 N -3.88 4.00 0.00 1.15 2.03 -1.26 -5.11 116.55 113.48 1wuz n ASP 102 Ca -0.02 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.42 1wuz n ASP 102 Cb 0.06 0.37 0.78 0.00 -0.72 0.00 0.00 41.12 41.61 1wuz n ASP 102 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87