#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wuz s ASN 2 N 0.00 5.23 0.00 1.61 0.01 -1.26 -4.99 114.94 115.54 1wuz s ASN 2 Ca 0.00 0.13 0.16 0.00 -0.71 0.00 0.00 52.86 52.44 1wuz s ASN 2 Cb 0.00 -1.51 0.26 0.00 0.41 0.00 0.00 41.25 40.42 1wuz s ASN 2 CO 0.00 0.36 1.08 -1.20 -1.51 0.00 0.00 177.10 175.83 1wuz n SER 3 N 2.26 0.46 -4.68 -1.22 7.64 -1.26 -5.09 113.62 111.74 1wuz n SER 3 Ca -0.18 -1.95 -0.42 0.00 1.01 0.00 0.00 58.87 57.32 1wuz n SER 3 Cb 0.54 -0.18 -0.03 0.00 -1.01 0.00 0.00 64.21 63.53 1wuz n SER 3 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1wuz s GLN 4 N 0.00 4.25 0.03 1.43 -0.21 -1.26 -1.87 119.66 122.03 1wuz s GLN 4 Ca 0.21 1.94 0.05 0.00 0.02 0.00 0.00 55.36 57.59 1wuz s GLN 4 Cb 0.24 -3.70 -0.02 0.00 1.00 0.00 0.00 33.01 30.53 1wuz s GLN 4 CO -0.10 -0.66 -0.16 0.42 -2.12 0.00 0.00 175.29 172.67 1wuz s ILE 5 N 2.97 1.25 0.18 1.08 -1.09 0.39 -4.98 121.20 121.01 1wuz s ILE 5 Ca 0.64 -0.95 0.09 0.00 -2.23 0.00 0.00 60.65 58.19 1wuz s ILE 5 Cb -0.30 -1.10 -0.04 0.00 -1.58 0.00 0.00 42.46 39.44 1wuz s ILE 5 CO 0.25 0.14 -0.07 -1.38 -1.23 0.00 0.00 174.94 172.64 1wuz s HIS 6 N -0.71 2.69 0.04 3.97 -3.43 -1.26 -1.97 115.29 114.61 1wuz s HIS 6 Ca 0.04 -0.20 -0.10 0.00 -0.80 0.00 0.00 55.06 54.00 1wuz s HIS 6 Cb -0.07 -1.30 0.00 0.00 -1.43 0.00 0.00 32.58 29.78 1wuz s HIS 6 CO 0.01 0.52 0.20 0.71 -2.00 0.00 0.00 174.74 174.18 1wuz s TYR 7 N -1.75 0.05 -0.13 0.38 1.51 0.86 -4.86 117.35 113.40 1wuz s TYR 7 Ca 0.26 -0.26 0.02 0.00 -1.01 0.00 0.00 57.07 56.08 1wuz s TYR 7 Cb -0.09 -0.02 0.02 0.00 -0.11 0.00 0.00 41.96 41.75 1wuz s TYR 7 CO 0.16 -0.43 -0.18 -1.12 -1.11 0.00 0.00 175.55 172.88 1wuz s SER 8 N -2.07 2.77 -0.11 2.29 0.01 -0.93 -2.76 113.70 112.91 1wuz s SER 8 Ca -0.05 -0.52 -0.04 0.00 1.31 0.00 0.00 55.95 56.65 1wuz s SER 8 Cb -0.01 -1.26 0.06 0.00 0.21 0.00 0.00 66.02 65.01 1wuz s SER 8 CO -0.04 0.02 0.17 -0.51 0.41 0.00 0.00 173.24 173.30 1wuz s ILE 9 N 1.06 -0.27 0.24 1.44 2.07 -0.98 -4.36 121.20 120.40 1wuz s ILE 9 Ca -0.03 0.27 -0.30 0.00 -1.41 0.00 0.00 60.65 59.17 1wuz s ILE 9 Cb -0.15 -0.37 -0.09 0.00 0.13 0.00 0.00 42.46 41.98 1wuz s ILE 9 CO -0.05 0.08 1.28 -2.16 -1.91 0.00 0.00 174.94 172.18 1wuz s PRO 10 N 2.30 4.42 0.94 3.50 0.04 -1.26 -2.36 135.00 142.57 1wuz s PRO 10 Ca 0.03 2.05 -0.14 0.00 0.04 0.00 0.00 61.00 62.98 1wuz s PRO 10 Cb -0.13 -3.17 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 1wuz s PRO 10 CO -0.07 -0.17 0.02 0.39 0.04 0.00 0.00 177.00 177.21 1wuz n GLU 11 N 2.03 -0.14 -1.55 4.56 1.02 -0.98 -2.26 120.64 123.31 1wuz n GLU 11 Ca 0.04 -0.01 -0.17 0.00 -0.02 0.00 0.00 57.16 57.00 1wuz n GLU 11 Cb 0.43 -1.57 -0.07 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 -0.23 -1.19 -1.65 3.49 2.13 -1.25 -4.87 120.64 117.07 1wuz n GLU 12 Ca 0.04 1.07 -0.38 0.00 0.66 0.00 0.00 57.16 58.55 1wuz n GLU 12 Cb 0.54 -5.31 -0.03 0.00 0.27 0.00 0.00 31.44 26.91 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 -2.64 2.03 1.03 4.31 0.00 -0.96 -4.87 121.76 120.65 1wuz s ALA 13 Ca 0.00 0.15 -0.12 0.00 0.00 0.00 0.00 51.96 51.99 1wuz s ALA 13 Cb 0.00 -4.26 0.19 0.00 0.00 0.00 0.00 23.12 19.06 1wuz s ALA 13 CO 0.00 -3.89 0.98 1.63 0.00 0.00 0.00 175.76 174.48 1wuz n LYS 14 N 8.94 -1.27 -1.64 0.00 5.02 -1.26 -4.58 118.16 123.37 1wuz n LYS 14 Ca 0.32 -0.32 -0.43 0.00 -2.02 0.00 0.00 58.31 55.87 1wuz n LYS 14 Cb 0.52 -2.23 -0.03 0.00 -0.02 0.00 0.00 35.03 33.27 1wuz n LYS 14 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1wuz n HIS 15 N -4.50 2.32 0.00 2.13 8.25 -1.26 -1.57 115.22 120.60 1wuz n HIS 15 Ca 0.08 -0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.26 1wuz n HIS 15 Cb 0.53 -2.77 0.00 0.00 1.12 0.00 0.00 29.99 28.87 1wuz n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wuz n GLY 16 N 4.96 1.07 3.77 -1.41 0.00 -0.43 -4.94 105.19 108.21 1wuz n GLY 16 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 3.47 0.14 2.61 2.01 -0.61 -4.67 115.64 116.60 1wuz s THR 17 Ca 0.00 1.27 -0.31 0.00 0.31 0.00 0.00 61.69 62.96 1wuz s THR 17 Cb 0.00 -3.72 -0.08 0.00 0.01 0.00 0.00 72.50 68.71 1wuz s THR 17 CO 0.00 0.14 1.31 -0.36 -0.69 0.00 0.00 174.62 175.02 1wuz s PHE 18 N -1.43 3.30 -0.00 4.92 0.40 -1.26 -2.29 117.98 121.61 1wuz s PHE 18 Ca 0.53 1.16 0.00 0.00 -0.60 0.00 0.00 56.93 58.03 1wuz s PHE 18 Cb -0.28 -3.58 -0.00 0.00 0.51 0.00 0.00 43.02 39.67 1wuz s PHE 18 CO 0.35 -1.88 0.00 0.28 0.70 0.00 0.00 175.22 174.67 1wuz n VAL 19 N 3.31 0.02 0.00 -0.44 0.31 -0.90 -4.73 118.33 115.90 1wuz n VAL 19 Ca 0.08 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1wuz n VAL 19 Cb 0.43 -0.91 0.00 0.00 -0.91 0.00 0.00 33.84 32.45 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 3.06 3.52 3.52 2.92 0.00 -1.26 -2.18 105.19 114.77 1wuz n GLY 20 Ca -0.01 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 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 0.39 -0.22 1.61 1.74 -1.26 -3.62 116.66 115.30 1wuz n ARG 21 Ca 0.00 -0.09 -0.05 0.00 -0.77 0.00 0.00 57.85 56.94 1wuz n ARG 21 Cb 0.00 -2.29 0.12 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 7.74 1.25 -0.30 0.55 2.10 -1.86 -2.69 117.51 124.30 1wuz h ILE 22 Ca -0.09 -0.83 -0.14 0.00 1.08 0.00 0.00 64.86 64.87 1wuz h ILE 22 Cb 1.24 0.47 -0.01 0.00 -1.09 0.00 0.00 36.82 37.43 1wuz h ILE 22 CO 1.31 0.33 -0.39 0.00 -1.08 0.00 0.00 178.15 178.31 1wuz h ALA 23 N 1.24 0.74 -0.13 0.18 0.00 -1.74 -2.54 119.26 117.02 1wuz h ALA 23 Ca 0.23 -0.45 0.03 0.00 0.00 0.00 0.00 54.91 54.72 1wuz h ALA 23 Cb 0.26 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1wuz h ALA 23 CO -0.01 0.66 -0.04 0.37 0.00 0.00 0.00 179.25 180.23 1wuz h GLN 24 N 0.59 -0.01 0.00 0.00 5.75 -1.71 0.51 115.11 120.24 1wuz h GLN 24 Ca 0.05 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.55 1wuz h GLN 24 Cb 0.93 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.49 1wuz h GLN 24 CO 0.09 -0.01 0.00 -0.40 -2.65 0.00 0.00 178.83 175.86 1wuz n ASP 25 N -5.17 0.04 0.05 -0.69 5.68 -1.07 -2.96 116.55 112.43 1wuz n ASP 25 Ca -0.04 0.51 -0.21 0.00 -0.50 0.00 0.00 54.79 54.54 1wuz n ASP 25 Cb 0.10 -0.52 -0.15 0.00 -1.14 0.00 0.00 41.12 39.42 1wuz n ASP 25 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1wuz h LEU 26 N 0.00 0.51 0.00 -2.12 4.07 -0.65 -3.49 115.31 113.64 1wuz h LEU 26 Ca 0.00 -0.87 0.00 0.00 0.08 0.00 0.00 57.88 57.09 1wuz h LEU 26 Cb 0.34 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.92 1wuz h LEU 26 CO 0.00 1.75 0.00 0.61 -1.08 0.00 0.00 178.44 179.72 1wuz n GLY 27 N 1.87 0.51 3.89 0.83 0.00 0.01 -5.04 105.19 107.25 1wuz n GLY 27 Ca -0.26 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 44.97 1wuz n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wuz s LEU 28 N 0.00 4.36 0.23 0.99 1.43 -1.25 -5.05 118.68 119.40 1wuz s LEU 28 Ca 0.00 0.49 -0.32 0.00 -1.03 0.00 0.00 54.13 53.28 1wuz s LEU 28 Cb 0.00 -2.69 -0.13 0.00 0.03 0.00 0.00 46.19 43.40 1wuz s LEU 28 CO 0.00 0.25 1.49 1.21 0.23 0.00 0.00 176.35 179.53 1wuz n GLU 29 N 1.01 2.22 0.22 1.70 4.07 -1.26 -4.85 120.64 123.75 1wuz n GLU 29 Ca -0.11 0.79 0.12 0.00 -0.06 0.00 0.00 57.16 57.90 1wuz n GLU 29 Cb 0.53 -2.51 0.70 0.00 -0.06 0.00 0.00 31.44 30.11 1wuz n GLU 29 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1wuz h LEU 30 N 4.76 0.00 -1.68 4.31 7.12 -1.96 0.13 115.31 128.00 1wuz h LEU 30 Ca -0.45 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.56 1wuz h LEU 30 Cb 1.26 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.39 1wuz h LEU 30 CO 0.80 0.00 0.00 0.35 -0.13 0.00 0.00 178.44 179.46 1wuz n THR 31 N -4.36 0.24 0.79 1.05 -2.24 -1.26 -3.91 114.28 104.60 1wuz n THR 31 Ca -0.01 -0.50 0.11 0.00 -2.27 0.00 0.00 64.05 61.38 1wuz n THR 31 Cb 0.19 0.84 -0.04 0.00 -2.10 0.00 0.00 70.33 69.21 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 0.92 0.14 -0.14 -0.78 -0.58 0.45 -4.29 120.64 116.36 1wuz n GLU 32 Ca 0.17 -0.02 -0.10 0.00 -0.42 0.00 0.00 57.16 56.78 1wuz n GLU 32 Cb 0.49 -1.52 -0.01 0.00 -0.57 0.00 0.00 31.44 29.82 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 0.74 0.17 -4.62 3.38 -1.64 -1.11 115.31 112.23 1wuz h LEU 33 Ca 0.00 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.66 1wuz h LEU 33 Cb 0.61 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1wuz h LEU 33 CO 0.00 0.88 -0.45 0.58 0.09 0.00 0.00 178.44 179.54 1wuz h VAL 34 N 0.58 0.11 0.00 1.22 2.07 -1.82 -1.35 116.25 117.06 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 0.51 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 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 -0.71 0.00 -0.25 1.57 0.13 -1.79 -2.40 132.00 128.55 1wuz h PRO 35 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 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 -0.23 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.08 1wuz n ARG 36 N -2.50 1.70 -3.88 0.86 1.74 -0.42 -4.92 116.66 109.24 1wuz n ARG 36 Ca 0.02 -1.08 -0.32 0.00 -0.77 0.00 0.00 57.85 55.69 1wuz n ARG 36 Cb 0.25 -1.30 0.01 0.00 -1.02 0.00 0.00 32.46 30.39 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 0.34 -2.07 -4.77 0.55 4.32 -0.90 -1.58 117.00 112.89 1wuz n LEU 37 Ca 0.13 -1.08 -0.40 0.00 -0.02 0.00 0.00 56.01 54.64 1wuz n LEU 37 Cb 0.28 -2.15 -0.00 0.00 -1.62 0.00 0.00 43.42 39.93 1wuz n LEU 37 CO 0.09 0.52 1.02 0.12 -1.22 0.00 0.00 177.39 177.92 1wuz s PHE 38 N -3.70 2.72 -0.00 -1.77 5.36 -1.02 -2.70 117.98 116.86 1wuz s PHE 38 Ca 0.29 1.34 -0.24 0.00 -0.96 0.00 0.00 56.93 57.36 1wuz s PHE 38 Cb -0.12 -3.79 0.05 0.00 -0.34 0.00 0.00 43.02 38.82 1wuz s PHE 38 CO 0.90 -2.42 0.52 1.03 -1.46 0.00 0.00 175.22 173.80 1wuz s ARG 39 N -2.22 0.95 -0.00 10.12 3.00 0.81 -4.98 118.95 126.64 1wuz s ARG 39 Ca 0.56 -0.04 0.04 0.00 0.00 0.00 0.00 55.73 56.29 1wuz s ARG 39 Cb -0.41 0.44 -0.01 0.00 0.00 0.00 0.00 34.95 34.97 1wuz s ARG 39 CO 0.53 -0.31 -0.12 0.08 0.00 0.00 0.00 175.30 175.49 1wuz s VAL 40 N -1.70 0.94 0.32 3.52 1.01 -1.26 -0.32 120.40 122.90 1wuz s VAL 40 Ca -0.09 -0.58 -0.19 0.00 0.00 0.00 0.00 61.98 61.12 1wuz s VAL 40 Cb -0.02 -0.80 0.04 0.00 0.00 0.00 0.00 36.38 35.60 1wuz s VAL 40 CO 0.04 0.21 0.75 0.00 0.00 0.00 0.00 175.10 176.11 1wuz s ALA 41 N -0.37 -1.03 0.10 5.51 0.00 -0.94 -4.90 121.76 120.13 1wuz s ALA 41 Ca 0.04 -0.49 -0.19 0.00 0.00 0.00 0.00 51.96 51.32 1wuz s ALA 41 Cb -0.05 0.77 0.04 0.00 0.00 0.00 0.00 23.12 23.89 1wuz s ALA 41 CO -0.00 -1.02 0.45 0.45 0.00 0.00 0.00 175.76 175.64 1wuz s SER 42 N -2.99 -0.33 0.27 0.00 0.15 -1.26 -2.39 113.70 107.15 1wuz s SER 42 Ca 0.13 -0.11 0.18 0.00 0.70 0.00 0.00 55.95 56.85 1wuz s SER 42 Cb -0.06 0.48 0.08 0.00 -1.71 0.00 0.00 66.02 64.82 1wuz s SER 42 CO 0.09 -0.80 1.33 0.11 1.20 0.00 0.00 173.24 175.17 1wuz h LYS 43 N 2.54 0.00 0.00 5.44 1.57 -1.96 -3.02 116.57 121.14 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 0.44 0.31 0.00 -0.25 -0.57 0.00 0.00 179.45 179.38 1wuz n ASP 44 N -3.09 0.00 0.00 0.86 9.92 -1.26 -4.69 116.55 118.29 1wuz n ASP 44 Ca 0.00 0.54 0.00 0.00 -0.53 0.00 0.00 54.79 54.81 1wuz n ASP 44 Cb 0.69 -0.09 0.00 0.00 -0.64 0.00 0.00 41.12 41.09 1wuz n ASP 44 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1wuz n ARG 45 N -0.76 0.99 0.00 -1.24 0.63 -1.26 -5.01 116.66 110.01 1wuz n ARG 45 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1wuz n ARG 45 Cb 0.00 -0.92 0.00 0.00 0.45 0.00 0.00 32.46 31.99 1wuz n ARG 45 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1wuz n GLY 46 N 2.21 2.31 2.26 5.14 0.00 -1.14 -4.89 105.19 111.09 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 0.00 1.06 -0.11 1.61 -0.08 -1.26 -4.27 116.55 113.51 1wuz n ASP 47 Ca 0.00 -2.92 -0.18 0.00 -1.51 0.00 0.00 54.79 50.18 1wuz n ASP 47 Cb 0.00 -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 1.03 2.36 -3.61 -2.67 4.32 -1.26 -4.56 117.00 112.61 1wuz n LEU 48 Ca 0.24 0.05 -0.14 0.00 -0.02 0.00 0.00 56.01 56.14 1wuz n LEU 48 Cb 0.53 -0.68 -0.06 0.00 -1.62 0.00 0.00 43.42 41.59 1wuz n LEU 48 CO 0.23 0.68 0.24 -0.76 -1.22 0.00 0.00 177.39 176.55 1wuz s LEU 49 N -6.62 0.07 0.02 2.23 1.02 -1.26 -2.35 118.68 111.79 1wuz s LEU 49 Ca -0.29 0.15 -0.02 0.00 0.02 0.00 0.00 54.13 53.99 1wuz s LEU 49 Cb 0.09 2.00 -0.01 0.00 0.02 0.00 0.00 46.19 48.29 1wuz s LEU 49 CO 0.43 -0.68 0.03 -1.61 0.02 0.00 0.00 176.35 174.53 1wuz s GLU 50 N -2.34 0.38 0.02 1.70 2.02 -1.04 -4.80 118.70 114.65 1wuz s GLU 50 Ca -0.06 -0.57 -0.13 0.00 0.02 0.00 0.00 54.97 54.23 1wuz s GLU 50 Cb -0.01 0.14 -0.06 0.00 0.10 0.00 0.00 34.13 34.31 1wuz s GLU 50 CO -0.01 -0.08 0.40 0.54 0.02 0.00 0.00 175.26 176.14 1wuz s VAL 51 N -1.54 5.05 -0.42 2.63 0.11 -1.26 -2.20 120.40 122.77 1wuz s VAL 51 Ca -0.15 0.74 -0.16 0.00 -2.93 0.00 0.00 61.98 59.48 1wuz s VAL 51 Cb -0.09 -3.69 0.03 0.00 -1.53 0.00 0.00 36.38 31.10 1wuz s VAL 51 CO -0.01 0.51 0.37 0.21 -3.33 0.00 0.00 175.10 172.85 1wuz s ASN 52 N -1.24 6.15 0.63 3.54 2.47 0.03 -4.92 114.94 121.60 1wuz s ASN 52 Ca 0.26 -0.86 0.31 0.00 0.42 0.00 0.00 52.86 52.98 1wuz s ASN 52 Cb -0.16 -2.19 1.68 0.00 -1.45 0.00 0.00 41.25 39.14 1wuz s ASN 52 CO 0.14 -0.53 1.94 -0.07 -3.72 0.00 0.00 177.10 174.87 1wuz h LEU 53 N 8.82 0.00 -0.83 3.21 3.38 -1.94 0.45 115.31 128.40 1wuz h LEU 53 Ca -0.27 0.00 0.17 0.00 0.09 0.00 0.00 57.88 57.87 1wuz h LEU 53 Cb 1.12 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.76 1wuz h LEU 53 CO 0.77 0.00 0.37 -0.61 0.09 0.00 0.00 178.44 179.06 1wuz h GLN 54 N 0.00 0.47 0.00 1.13 5.75 -1.94 -3.25 115.11 117.27 1wuz h GLN 54 Ca 0.00 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1wuz h GLN 54 Cb 0.53 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.98 1wuz h GLN 54 CO 0.00 0.31 -0.32 -1.71 -2.65 0.00 0.00 178.83 174.46 1wuz n ASN 55 N -4.98 0.00 -2.10 -0.69 5.15 -0.67 -4.99 115.26 106.99 1wuz n ASN 55 Ca 0.18 -1.64 -0.16 0.00 -0.60 0.00 0.00 54.58 52.35 1wuz n ASN 55 Cb 0.49 -0.13 -0.03 0.00 -0.53 0.00 0.00 39.78 39.59 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 0.00 0.20 3.90 8.20 0.00 0.15 -4.92 105.19 112.72 1wuz n GLY 56 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1wuz n GLY 56 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1wuz s ILE 57 N -2.66 5.08 -0.36 -0.61 1.10 -1.16 -2.19 121.20 120.40 1wuz s ILE 57 Ca 0.00 0.06 -0.17 0.00 -0.51 0.00 0.00 60.65 60.04 1wuz s ILE 57 Cb 0.00 -3.67 -0.00 0.00 0.15 0.00 0.00 42.46 38.94 1wuz s ILE 57 CO 0.00 -0.13 0.44 -0.22 -2.11 0.00 0.00 174.94 172.92 1wuz s LEU 58 N -3.06 4.47 0.02 8.50 1.98 -1.24 -0.79 118.68 128.56 1wuz s LEU 58 Ca 0.43 -0.23 0.04 0.00 -2.89 0.00 0.00 54.13 51.48 1wuz s LEU 58 Cb -0.11 -2.45 -0.03 0.00 0.66 0.00 0.00 46.19 44.26 1wuz s LEU 58 CO 0.26 -0.44 -0.10 0.72 -1.89 0.00 0.00 176.35 174.91 1wuz s PHE 59 N 2.19 2.80 0.43 5.38 -0.12 -0.93 -2.12 117.98 125.61 1wuz s PHE 59 Ca 0.15 -0.10 -0.23 0.00 -0.05 0.00 0.00 56.93 56.69 1wuz s PHE 59 Cb -0.16 -1.56 -0.08 0.00 -0.63 0.00 0.00 43.02 40.59 1wuz s PHE 59 CO 0.13 0.35 1.10 0.08 -0.05 0.00 0.00 175.22 176.82 1wuz s VAL 60 N -1.00 3.47 -0.35 -2.49 1.01 -0.97 -2.50 120.40 117.57 1wuz s VAL 60 Ca 0.17 1.11 0.14 0.00 0.00 0.00 0.00 61.98 63.40 1wuz s VAL 60 Cb -0.11 -3.56 0.43 0.00 0.00 0.00 0.00 36.38 33.14 1wuz s VAL 60 CO 0.08 -0.01 1.14 -3.20 0.00 0.00 0.00 175.10 173.10 1wuz n ASN 61 N -0.29 0.00 -0.98 3.32 2.85 -0.99 -1.31 115.26 117.87 1wuz n ASN 61 Ca 0.06 -2.56 0.00 0.00 -0.11 0.00 0.00 54.58 51.97 1wuz n ASN 61 Cb 0.49 0.13 0.00 0.00 1.24 0.00 0.00 39.78 41.65 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 -0.35 0.00 -4.66 1.20 2.88 -1.16 -4.43 113.62 107.10 1wuz n SER 62 Ca 0.03 -0.98 -0.40 0.00 -1.33 0.00 0.00 58.87 56.19 1wuz n SER 62 Cb 0.83 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.24 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 -1.94 4.22 -0.01 -1.46 1.81 -1.26 -4.74 118.95 115.56 1wuz s ARG 63 Ca 0.00 0.66 0.13 0.00 -1.72 0.00 0.00 55.73 54.80 1wuz s ARG 63 Cb 0.00 -3.58 -0.18 0.00 -0.45 0.00 0.00 34.95 30.74 1wuz s ARG 63 CO 0.00 -0.25 0.34 -0.89 -0.68 0.00 0.00 175.30 173.82 1wuz n ILE 64 N 4.70 0.00 -1.54 1.52 2.08 -1.26 -4.10 119.36 120.76 1wuz n ILE 64 Ca -0.01 -0.27 -0.45 0.00 0.56 0.00 0.00 62.75 62.58 1wuz n ILE 64 Cb 0.50 0.39 -0.02 0.00 -0.75 0.00 0.00 39.64 39.76 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 -1.80 0.54 -0.28 4.38 2.03 -1.26 -3.85 116.55 116.31 1wuz n ASP 65 Ca -0.01 1.14 0.29 0.00 0.52 0.00 0.00 54.79 56.72 1wuz n ASP 65 Cb 0.30 -1.20 0.65 0.00 -0.72 0.00 0.00 41.12 40.15 1wuz n ASP 65 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 1wuz h ARG 66 N 1.64 0.15 -0.31 -0.67 0.11 -1.95 0.55 114.38 113.90 1wuz h ARG 66 Ca -0.37 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 59.68 1wuz h ARG 66 Cb 1.37 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 32.40 1wuz h ARG 66 CO 0.59 0.10 0.14 1.49 0.10 0.00 0.00 179.97 182.39 1wuz h GLU 67 N 0.15 0.46 0.00 0.08 4.22 -1.86 0.40 114.58 118.02 1wuz h GLU 67 Ca 0.53 -0.07 -0.03 0.00 0.08 0.00 0.00 59.36 59.88 1wuz h GLU 67 Cb 1.82 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.98 1wuz h GLU 67 CO -0.11 0.44 -0.23 0.93 -2.18 0.00 0.00 179.01 177.86 1wuz h GLU 68 N 0.37 0.00 0.00 1.92 4.39 -1.06 -3.41 114.58 116.79 1wuz h GLU 68 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1wuz h GLU 68 Cb 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1wuz h GLU 68 CO -0.01 0.37 0.00 -0.11 -1.16 0.00 0.00 179.01 178.10 1wuz n LEU 69 N -4.67 0.00 0.08 1.33 -0.00 0.16 -4.90 117.00 109.01 1wuz n LEU 69 Ca -0.07 0.90 0.00 0.00 -0.00 0.00 0.00 56.01 56.83 1wuz n LEU 69 Cb 0.25 -0.40 0.00 0.00 -0.00 0.00 0.00 43.42 43.27 1wuz n LEU 69 CO 0.13 -0.40 0.00 0.00 -0.00 0.00 0.00 177.39 177.12 1wuz n GLY 71 N -1.43 0.65 0.00 0.00 0.00 0.13 -4.74 105.19 99.80 1wuz n GLY 71 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.89 0.00 -3.98 1.61 5.12 -1.26 -4.92 116.66 112.34 1wuz n ARG 72 Ca -0.06 0.27 -0.26 0.00 -1.93 0.00 0.00 57.85 55.87 1wuz n ARG 72 Cb 0.43 -0.89 -0.04 0.00 -1.16 0.00 0.00 32.46 30.80 1wuz n ARG 72 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1wuz s SER 73 N -2.06 6.12 0.53 0.55 0.15 -1.26 -4.98 113.70 112.75 1wuz s SER 73 Ca 0.00 0.09 0.31 0.00 0.70 0.00 0.00 55.95 57.05 1wuz s SER 73 Cb 0.00 -1.79 1.46 0.00 -1.71 0.00 0.00 66.02 63.99 1wuz s SER 73 CO 0.00 0.06 1.90 0.00 1.20 0.00 0.00 173.24 176.40 1wuz h ALA 74 N 2.23 2.79 -3.59 5.45 0.00 -1.96 -3.35 119.26 120.84 1wuz h ALA 74 Ca -0.48 -0.03 -0.66 0.00 0.00 0.00 0.00 54.91 53.74 1wuz h ALA 74 Cb 1.20 0.06 -0.36 0.00 0.00 0.00 0.00 17.79 18.68 1wuz h ALA 74 CO 0.67 -1.04 -0.82 -1.83 0.00 0.00 0.00 179.25 176.24 1wuz s GLU 75 N -4.99 2.43 -0.16 0.00 -1.05 -1.26 -4.73 118.70 108.93 1wuz s GLU 75 Ca -0.05 -1.14 -0.02 0.00 -0.15 0.00 0.00 54.97 53.60 1wuz s GLU 75 Cb 0.21 -2.75 -0.02 0.00 -0.44 0.00 0.00 34.13 31.14 1wuz s GLU 75 CO 0.77 -0.45 -0.08 0.00 0.95 0.00 0.00 175.26 176.45 1wuz s SER 77 N 0.62 5.61 0.02 0.00 1.04 -1.26 -2.39 113.70 117.35 1wuz s SER 77 Ca -0.05 0.19 0.08 0.00 0.48 0.00 0.00 55.95 56.65 1wuz s SER 77 Cb -0.15 -1.78 -0.03 0.00 0.10 0.00 0.00 66.02 64.16 1wuz s SER 77 CO 0.03 0.31 -0.24 -0.63 0.98 0.00 0.00 173.24 173.69 1wuz s ILE 78 N -0.46 2.32 -0.02 -1.02 1.09 -0.81 -5.01 121.20 117.28 1wuz s ILE 78 Ca 0.10 -1.24 0.05 0.00 -1.10 0.00 0.00 60.65 58.45 1wuz s ILE 78 Cb -0.12 -1.90 -0.03 0.00 -1.06 0.00 0.00 42.46 39.36 1wuz s ILE 78 CO 0.02 0.42 -0.15 -1.00 -0.10 0.00 0.00 174.94 174.13 1wuz s HIS 79 N -0.78 2.65 0.04 3.97 3.76 -1.26 -2.03 115.29 121.64 1wuz s HIS 79 Ca 0.12 -0.19 -0.03 0.00 -0.15 0.00 0.00 55.06 54.80 1wuz s HIS 79 Cb -0.10 -1.57 -0.02 0.00 1.11 0.00 0.00 32.58 31.99 1wuz s HIS 79 CO 0.02 0.20 0.04 -1.17 -0.85 0.00 0.00 174.74 172.98 1wuz s LEU 80 N -0.97 2.09 -0.11 0.89 0.20 0.85 -4.80 118.68 116.84 1wuz s LEU 80 Ca 0.13 -0.70 0.00 0.00 0.69 0.00 0.00 54.13 54.25 1wuz s LEU 80 Cb -0.11 0.40 0.02 0.00 -0.43 0.00 0.00 46.19 46.08 1wuz s LEU 80 CO 0.02 -0.52 -0.10 -1.61 -0.29 0.00 0.00 176.35 173.85 1wuz s GLU 81 N -2.95 1.73 -0.45 1.98 2.02 -1.01 -2.22 118.70 117.80 1wuz s GLU 81 Ca -0.02 -0.35 -0.19 0.00 0.02 0.00 0.00 54.97 54.43 1wuz s GLU 81 Cb 0.01 -1.66 0.03 0.00 0.10 0.00 0.00 34.13 32.61 1wuz s GLU 81 CO -0.06 -0.20 0.57 0.08 0.02 0.00 0.00 175.26 175.67 1wuz s VAL 82 N 1.44 4.93 -0.36 2.63 1.01 -1.05 -2.22 120.40 126.78 1wuz s VAL 82 Ca 0.01 -0.23 -0.29 0.00 0.00 0.00 0.00 61.98 61.47 1wuz s VAL 82 Cb -0.13 -4.18 0.02 0.00 0.00 0.00 0.00 36.38 32.09 1wuz s VAL 82 CO -0.06 -0.60 1.16 -0.63 0.00 0.00 0.00 175.10 174.97 1wuz s ILE 83 N 2.53 4.32 -0.10 2.22 1.09 0.56 -2.29 121.20 129.53 1wuz s ILE 83 Ca 0.17 1.47 0.04 0.00 -1.10 0.00 0.00 60.65 61.22 1wuz s ILE 83 Cb -0.17 -4.40 0.00 0.00 -1.06 0.00 0.00 42.46 36.84 1wuz s ILE 83 CO 0.15 -0.63 -0.22 0.68 -0.10 0.00 0.00 174.94 174.82 1wuz s VAL 84 N 4.11 1.89 -0.29 2.92 -7.23 -0.98 -0.13 120.40 120.69 1wuz s VAL 84 Ca 0.49 -0.92 -0.10 0.00 -1.81 0.00 0.00 61.98 59.64 1wuz s VAL 84 Cb -0.12 -1.65 -0.03 0.00 0.56 0.00 0.00 36.38 35.15 1wuz s VAL 84 CO 0.22 0.52 0.16 -0.62 -0.31 0.00 0.00 175.10 175.07 1wuz s ASP 85 N 0.43 5.68 -0.20 4.85 2.15 -0.61 -2.57 116.67 126.39 1wuz s ASP 85 Ca -0.18 -0.30 -0.04 0.00 0.43 0.00 0.00 52.55 52.47 1wuz s ASP 85 Cb -0.17 -2.04 0.00 0.00 -0.30 0.00 0.00 42.92 40.41 1wuz s ASP 85 CO 0.07 -0.13 0.14 -1.14 -0.17 0.00 0.00 175.17 173.95 1wuz n ARG 86 N 5.01 -1.66 -1.36 4.34 0.00 -1.26 -3.64 116.66 118.08 1wuz n ARG 86 Ca -0.14 1.61 -0.31 0.00 -0.00 0.00 0.00 57.85 59.00 1wuz n ARG 86 Cb 0.50 -3.59 0.08 0.00 0.00 0.00 0.00 32.46 29.46 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 -1.33 2.37 -0.54 -0.14 0.04 -1.26 -4.54 135.00 129.60 1wuz s PRO 87 Ca 0.06 1.22 -0.22 0.00 0.04 0.00 0.00 61.00 62.10 1wuz s PRO 87 Cb -0.02 -1.91 0.05 0.00 0.04 0.00 0.00 34.50 32.67 1wuz s PRO 87 CO 0.43 -1.57 0.80 -0.51 0.04 0.00 0.00 177.00 176.19 1wuz s LEU 88 N -5.70 4.52 0.00 -3.56 1.43 -1.26 -4.71 118.68 109.40 1wuz s LEU 88 Ca 0.62 -0.65 -0.16 0.00 -1.03 0.00 0.00 54.13 52.91 1wuz s LEU 88 Cb -0.18 -2.63 0.05 0.00 0.03 0.00 0.00 46.19 43.47 1wuz s LEU 88 CO 0.53 -1.09 0.74 0.00 0.23 0.00 0.00 176.35 176.76 1wuz n GLN 89 N 6.90 0.15 -4.24 1.70 1.13 -1.06 -5.06 117.38 116.90 1wuz n GLN 89 Ca -0.02 -0.53 -0.19 0.00 -1.94 0.00 0.00 57.00 54.32 1wuz n GLN 89 Cb 0.46 0.83 -0.11 0.00 0.11 0.00 0.00 30.24 31.53 1wuz n GLN 89 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1wuz s VAL 90 N -2.10 1.37 -0.09 5.09 1.01 -1.26 -2.31 120.40 122.11 1wuz s VAL 90 Ca 0.17 -1.61 -0.01 0.00 0.00 0.00 0.00 61.98 60.53 1wuz s VAL 90 Cb -0.01 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1wuz s VAL 90 CO 0.00 -0.31 -0.03 -0.36 0.00 0.00 0.00 175.10 174.40 1wuz s PHE 91 N -1.79 3.07 -0.48 5.22 0.08 -0.97 -4.90 117.98 118.22 1wuz s PHE 91 Ca 0.06 0.09 -0.27 0.00 0.12 0.00 0.00 56.93 56.94 1wuz s PHE 91 Cb -0.07 -1.78 0.03 0.00 -0.57 0.00 0.00 43.02 40.63 1wuz s PHE 91 CO 0.03 0.37 1.01 -1.01 -0.10 0.00 0.00 175.22 175.52 1wuz s HIS 92 N -0.73 2.87 -0.16 0.36 3.76 -0.78 -2.54 115.29 118.06 1wuz s HIS 92 Ca 0.11 0.47 0.00 0.00 -0.15 0.00 0.00 55.06 55.50 1wuz s HIS 92 Cb -0.11 -4.15 0.00 0.00 1.11 0.00 0.00 32.58 29.42 1wuz s HIS 92 CO 0.02 -1.19 -0.16 0.08 -0.85 0.00 0.00 174.74 172.65 1wuz s VAL 93 N 4.04 2.58 -0.14 -0.90 1.01 -0.94 -0.46 120.40 125.59 1wuz s VAL 93 Ca 0.41 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.59 1wuz s VAL 93 Cb -0.09 -2.09 0.02 0.00 0.00 0.00 0.00 36.38 34.22 1wuz s VAL 93 CO 0.28 0.51 -0.11 -1.61 0.00 0.00 0.00 175.10 174.17 1wuz s GLU 94 N 0.94 1.99 -0.19 2.72 2.02 -0.83 -0.10 118.70 125.24 1wuz s GLU 94 Ca -0.03 -0.46 -0.01 0.00 0.02 0.00 0.00 54.97 54.48 1wuz s GLU 94 Cb -0.15 -1.93 0.00 0.00 0.10 0.00 0.00 34.13 32.15 1wuz s GLU 94 CO -0.02 -0.26 -0.12 0.14 0.02 0.00 0.00 175.26 175.02 1wuz s VAL 95 N 1.57 2.82 0.17 2.63 -7.23 -0.86 -0.10 120.40 119.40 1wuz s VAL 95 Ca 0.05 -0.69 0.01 0.00 -1.81 0.00 0.00 61.98 59.53 1wuz s VAL 95 Cb -0.13 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.54 1wuz s VAL 95 CO -0.10 0.48 0.34 -1.61 -0.31 0.00 0.00 175.10 173.90 1wuz s GLU 96 N 1.25 3.48 -0.23 4.82 2.02 -1.11 -1.93 118.70 127.00 1wuz s GLU 96 Ca 0.03 -0.47 -0.12 0.00 0.02 0.00 0.00 54.97 54.43 1wuz s GLU 96 Cb -0.14 -2.90 -0.05 0.00 0.10 0.00 0.00 34.13 31.14 1wuz s GLU 96 CO -0.06 0.46 0.23 0.14 0.02 0.00 0.00 175.26 176.06 1wuz s VAL 97 N -1.81 5.31 -0.34 2.63 -7.23 -1.00 -2.31 120.40 115.65 1wuz s VAL 97 Ca 0.36 0.33 -0.11 0.00 -1.81 0.00 0.00 61.98 60.76 1wuz s VAL 97 Cb -0.11 -3.57 0.00 0.00 0.56 0.00 0.00 36.38 33.26 1wuz s VAL 97 CO 0.29 0.31 0.18 -0.60 -0.31 0.00 0.00 175.10 174.97 1wuz s ARG 98 N 1.22 3.17 0.00 4.82 3.52 -1.00 -4.49 118.95 126.19 1wuz s ARG 98 Ca 0.11 -0.84 0.00 0.00 -0.13 0.00 0.00 55.73 54.86 1wuz s ARG 98 Cb -0.14 -3.66 0.00 0.00 -1.56 0.00 0.00 34.95 29.59 1wuz s ARG 98 CO 0.06 -0.53 0.00 -3.47 -0.81 0.00 0.00 175.30 170.55 1wuz n ASP 99 N 5.01 0.00 -4.69 -2.12 2.03 -1.26 -2.33 116.55 113.19 1wuz n ASP 99 Ca -0.13 -0.98 -0.25 0.00 0.52 0.00 0.00 54.79 53.96 1wuz n ASP 99 Cb 0.48 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.81 1wuz n ASP 99 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1wuz s ILE 100 N -2.01 3.80 -0.07 5.18 -4.36 -1.26 -4.96 121.20 117.52 1wuz s ILE 100 Ca 0.00 -1.53 -0.20 0.00 -0.26 0.00 0.00 60.65 58.66 1wuz s ILE 100 Cb 0.00 -2.97 -0.30 0.00 1.25 0.00 0.00 42.46 40.45 1wuz s ILE 100 CO 0.00 -0.22 0.77 -1.13 0.24 0.00 0.00 174.94 174.60 1wuz h ASN 101 N 2.29 0.42 -0.14 4.36 -0.73 -1.95 -3.30 115.58 116.54 1wuz h ASN 101 Ca -0.47 -0.91 0.04 0.00 1.87 0.00 0.00 56.30 56.83 1wuz h ASN 101 Cb 1.22 -0.14 -0.01 0.00 0.27 0.00 0.00 38.32 39.67 1wuz h ASN 101 CO 0.59 1.46 0.11 0.44 -0.37 0.00 0.00 177.43 179.67 1wuz h ASP 102 N -0.37 0.00 0.00 1.15 5.19 -2.01 -3.51 116.42 116.86 1wuz h ASP 102 Ca -0.20 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.21 1wuz h ASP 102 Cb 1.66 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.17 1wuz h ASP 102 CO 0.11 0.00 0.00 -3.20 -3.12 0.00 0.00 179.24 173.03