#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 7.04 -0.07 1.61 -0.87 -1.26 -4.98 114.94 116.40 1wuz s ASN 2 Ca 0.00 1.33 0.16 0.00 -1.57 0.00 0.00 52.86 52.78 1wuz s ASN 2 Cb 0.00 -2.38 0.33 0.00 -0.02 0.00 0.00 41.25 39.17 1wuz s ASN 2 CO 0.00 0.11 1.15 -1.20 -2.57 0.00 0.00 177.10 174.59 1wuz n SER 3 N 1.02 1.17 -4.59 -1.22 7.64 -1.26 -5.04 113.62 111.34 1wuz n SER 3 Ca -0.05 -2.65 -0.43 0.00 1.01 0.00 0.00 58.87 56.75 1wuz n SER 3 Cb 0.51 -0.36 -0.04 0.00 -1.01 0.00 0.00 64.21 63.31 1wuz n SER 3 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wuz s GLN 4 N -1.24 3.72 -0.09 1.43 1.03 -1.26 -1.35 119.66 121.91 1wuz s GLN 4 Ca 0.28 0.36 -0.10 0.00 0.04 0.00 0.00 55.36 55.94 1wuz s GLN 4 Cb 0.30 -3.84 0.03 0.00 0.03 0.00 0.00 33.01 29.53 1wuz s GLN 4 CO -0.09 -0.97 0.27 0.42 -2.54 0.00 0.00 175.29 172.38 1wuz s ILE 5 N 3.37 0.01 0.01 3.63 1.09 -0.63 -5.01 121.20 123.67 1wuz s ILE 5 Ca 0.35 -0.07 -0.01 0.00 -1.10 0.00 0.00 60.65 59.82 1wuz s ILE 5 Cb -0.12 -0.41 -0.01 0.00 -1.06 0.00 0.00 42.46 40.86 1wuz s ILE 5 CO 0.20 -0.04 0.00 -1.38 -0.10 0.00 0.00 174.94 173.62 1wuz s HIS 6 N -0.04 0.19 0.38 3.97 -3.43 -1.26 -1.18 115.29 113.92 1wuz s HIS 6 Ca -0.02 -0.39 0.08 0.00 -0.80 0.00 0.00 55.06 53.93 1wuz s HIS 6 Cb -0.02 -0.14 -0.07 0.00 -1.43 0.00 0.00 32.58 30.91 1wuz s HIS 6 CO 0.01 -0.18 -0.01 0.71 -2.00 0.00 0.00 174.74 173.27 1wuz s TYR 7 N -1.24 2.49 -0.12 0.38 2.02 -0.63 -4.92 117.35 115.33 1wuz s TYR 7 Ca -0.14 -0.58 0.02 0.00 -0.37 0.00 0.00 57.07 55.99 1wuz s TYR 7 Cb -0.08 -1.64 0.02 0.00 -0.40 0.00 0.00 41.96 39.85 1wuz s TYR 7 CO -0.00 0.47 -0.16 -1.12 -1.57 0.00 0.00 175.55 173.17 1wuz s SER 8 N -3.70 2.59 -0.05 2.29 0.01 -0.99 -2.75 113.70 111.11 1wuz s SER 8 Ca 0.35 -0.47 -0.02 0.00 1.31 0.00 0.00 55.95 57.12 1wuz s SER 8 Cb 0.06 -1.16 0.04 0.00 0.21 0.00 0.00 66.02 65.16 1wuz s SER 8 CO 0.18 0.01 0.11 -0.51 0.41 0.00 0.00 173.24 173.44 1wuz s ILE 9 N 1.07 -0.08 0.23 1.44 2.07 -1.08 -4.55 121.20 120.31 1wuz s ILE 9 Ca -0.04 0.22 -0.30 0.00 -1.41 0.00 0.00 60.65 59.12 1wuz s ILE 9 Cb -0.14 -0.20 -0.09 0.00 0.13 0.00 0.00 42.46 42.16 1wuz s ILE 9 CO -0.04 0.09 1.28 -2.16 -1.91 0.00 0.00 174.94 172.20 1wuz s PRO 10 N 1.30 4.41 0.84 3.50 0.04 -1.26 -2.45 135.00 141.39 1wuz s PRO 10 Ca -0.07 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 62.86 1wuz s PRO 10 Cb -0.12 -3.18 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 1wuz s PRO 10 CO -0.05 -0.19 0.23 0.39 0.04 0.00 0.00 177.00 177.43 1wuz n GLU 11 N 2.18 0.00 -2.51 4.56 1.02 -1.05 -2.55 120.64 122.30 1wuz n GLU 11 Ca 0.04 0.04 -0.19 0.00 -0.02 0.00 0.00 57.16 57.03 1wuz n GLU 11 Cb 0.43 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 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 -0.48 -2.26 -2.34 3.49 2.13 -1.19 -4.90 120.64 115.10 1wuz n GLU 12 Ca 0.07 0.90 -0.37 0.00 0.66 0.00 0.00 57.16 58.42 1wuz n GLU 12 Cb 0.52 -5.50 -0.04 0.00 0.27 0.00 0.00 31.44 26.70 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 -2.99 2.35 0.77 4.31 0.00 -1.06 -4.81 121.76 120.33 1wuz s ALA 13 Ca 0.07 -1.60 -0.15 0.00 0.00 0.00 0.00 51.96 50.27 1wuz s ALA 13 Cb -0.03 -4.44 -0.02 0.00 0.00 0.00 0.00 23.12 18.63 1wuz s ALA 13 CO 0.08 -3.91 0.54 1.63 0.00 0.00 0.00 175.76 174.11 1wuz n LYS 14 N 9.04 0.19 -1.63 0.00 4.76 -1.26 -4.51 118.16 124.75 1wuz n LYS 14 Ca 0.26 0.11 -0.51 0.00 -2.87 0.00 0.00 58.31 55.31 1wuz n LYS 14 Cb 0.50 -1.87 -0.05 0.00 -1.84 0.00 0.00 35.03 31.76 1wuz n LYS 14 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1wuz n HIS 15 N -2.65 1.87 0.00 2.13 8.25 -1.26 -2.09 115.22 121.47 1wuz n HIS 15 Ca 0.10 0.46 0.00 0.00 -0.26 0.00 0.00 57.72 58.02 1wuz n HIS 15 Cb 0.51 -2.44 0.00 0.00 1.12 0.00 0.00 29.99 29.18 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 3.13 0.87 3.70 -1.41 0.00 -0.97 -4.87 105.19 105.63 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 -2.00 5.07 0.82 2.61 2.01 -0.89 -4.63 115.64 118.63 1wuz s THR 17 Ca 0.00 1.24 -0.13 0.00 0.31 0.00 0.00 61.69 63.11 1wuz s THR 17 Cb 0.00 -3.96 0.09 0.00 0.01 0.00 0.00 72.50 68.64 1wuz s THR 17 CO 0.00 0.21 1.18 0.33 -0.69 0.00 0.00 174.62 175.65 1wuz n PHE 18 N 4.24 1.17 0.03 4.92 -0.00 -1.26 -1.17 117.46 125.39 1wuz n PHE 18 Ca -0.02 0.40 0.00 0.00 -0.00 0.00 0.00 57.45 57.83 1wuz n PHE 18 Cb 0.51 -2.09 0.00 0.00 -0.00 0.00 0.00 39.48 37.90 1wuz n PHE 18 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1wuz n VAL 19 N -3.37 0.28 0.00 -2.13 0.31 -0.58 -4.80 118.33 108.04 1wuz n VAL 19 Ca 0.13 0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.55 1wuz n VAL 19 Cb 0.51 -1.22 0.00 0.00 -0.91 0.00 0.00 33.84 32.21 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 2.66 2.61 3.50 2.92 0.00 -1.26 -2.33 105.19 113.29 1wuz n GLY 20 Ca 0.00 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1wuz n GLY 20 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1wuz n ARG 21 N -0.42 0.79 -0.02 1.61 0.63 -1.26 -4.28 116.66 113.71 1wuz n ARG 21 Ca 0.00 0.10 -0.13 0.00 -0.92 0.00 0.00 57.85 56.90 1wuz n ARG 21 Cb 0.00 -2.60 -0.01 0.00 0.45 0.00 0.00 32.46 30.30 1wuz n ARG 21 CO 0.00 0.00 0.00 0.97 -2.51 0.00 0.00 177.63 176.09 1wuz h ILE 22 N 7.58 1.30 0.05 5.15 2.10 -1.95 -2.67 117.51 129.06 1wuz h ILE 22 Ca -0.20 -1.86 -0.00 0.00 1.08 0.00 0.00 64.86 63.88 1wuz h ILE 22 Cb 1.30 1.81 0.00 0.00 -1.09 0.00 0.00 36.82 38.84 1wuz h ILE 22 CO 1.17 0.59 -0.02 0.00 -1.08 0.00 0.00 178.15 178.81 1wuz h ALA 23 N 0.78 -0.06 -0.93 0.18 0.00 -1.87 -1.32 119.26 116.04 1wuz h ALA 23 Ca -0.01 -0.23 0.11 0.00 0.00 0.00 0.00 54.91 54.78 1wuz h ALA 23 Cb 1.21 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.95 1wuz h ALA 23 CO 0.13 -0.29 0.57 0.37 0.00 0.00 0.00 179.25 180.02 1wuz h GLN 24 N -0.55 0.88 0.00 0.00 -0.00 -1.83 0.33 115.11 113.94 1wuz h GLN 24 Ca -0.01 -0.05 -0.04 0.00 -0.00 0.00 0.00 58.65 58.55 1wuz h GLN 24 Cb 0.49 -0.20 -0.01 0.00 0.00 0.00 0.00 27.48 27.77 1wuz h GLN 24 CO 0.01 0.58 -0.18 -0.44 0.00 0.00 0.00 178.83 178.80 1wuz h ASP 25 N 0.91 0.00 0.29 -0.69 3.32 -1.47 -3.21 116.42 115.56 1wuz h ASP 25 Ca 0.46 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 57.17 1wuz h ASP 25 Cb 0.45 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.03 1wuz h ASP 25 CO -0.26 0.18 -1.53 -0.07 -1.72 0.00 0.00 179.24 175.84 1wuz h LEU 26 N 0.00 0.75 -0.27 1.55 4.07 0.41 -3.47 115.31 118.35 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 0.91 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 42.41 1wuz h LEU 26 CO 0.02 1.69 0.00 0.61 -1.08 0.00 0.00 178.44 179.69 1wuz n GLY 27 N 1.73 1.03 3.07 0.83 0.00 0.88 -5.06 105.19 107.68 1wuz n GLY 27 Ca -0.18 -0.21 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.27 2.19 0.02 0.99 0.05 -1.21 -5.08 118.68 115.36 1wuz s LEU 28 Ca 0.00 -0.44 -0.30 0.00 0.05 0.00 0.00 54.13 53.44 1wuz s LEU 28 Cb 0.00 -0.31 -0.06 0.00 -2.05 0.00 0.00 46.19 43.76 1wuz s LEU 28 CO 0.00 -0.08 1.51 -1.61 -0.55 0.00 0.00 176.35 175.61 1wuz s GLU 29 N -1.19 4.24 0.46 1.48 2.02 -1.26 -4.67 118.70 119.79 1wuz s GLU 29 Ca -0.04 2.10 0.32 0.00 0.02 0.00 0.00 54.97 57.37 1wuz s GLU 29 Cb -0.08 -3.62 1.63 0.00 0.10 0.00 0.00 34.13 32.16 1wuz s GLU 29 CO 0.01 -0.65 1.96 -0.07 0.02 0.00 0.00 175.26 176.52 1wuz h LEU 30 N 8.59 0.00 -0.43 1.80 3.38 -1.95 0.10 115.31 126.80 1wuz h LEU 30 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1wuz h LEU 30 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1wuz h LEU 30 CO 0.92 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.80 1wuz n THR 31 N -2.64 0.06 -0.16 0.22 -2.24 -1.26 -3.22 114.28 105.03 1wuz n THR 31 Ca -0.01 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1wuz n THR 31 Cb 0.10 -0.04 0.00 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 1.60 -0.13 -0.78 -0.58 0.02 -4.73 120.64 115.65 1wuz n GLU 32 Ca 0.17 -1.09 -0.11 0.00 -0.42 0.00 0.00 57.16 55.71 1wuz n GLU 32 Cb 0.18 -0.92 -0.02 0.00 -0.57 0.00 0.00 31.44 30.12 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 0.73 0.17 -4.62 3.38 -1.55 -1.26 115.31 112.16 1wuz h LEU 33 Ca 0.00 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.64 1wuz h LEU 33 Cb 0.45 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1wuz h LEU 33 CO 0.00 0.90 -0.42 0.58 0.09 0.00 0.00 178.44 179.59 1wuz h VAL 34 N 0.54 0.15 0.00 1.22 2.07 -1.85 -1.25 116.25 117.14 1wuz h VAL 34 Ca 0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.62 1wuz h VAL 34 Cb 0.56 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 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 -0.69 0.00 -0.18 1.57 0.13 -1.89 -2.28 132.00 128.67 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 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 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 -2.43 1.85 -3.86 0.86 1.74 -0.48 -4.93 116.66 109.42 1wuz n ARG 36 Ca 0.02 -1.27 -0.33 0.00 -0.77 0.00 0.00 57.85 55.49 1wuz n ARG 36 Cb 0.24 -1.42 0.02 0.00 -1.02 0.00 0.00 32.46 30.28 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 0.50 -2.09 -4.71 0.55 7.99 -0.69 -1.62 117.00 116.93 1wuz n LEU 37 Ca 0.17 -1.08 -0.42 0.00 -0.01 0.00 0.00 56.01 54.67 1wuz n LEU 37 Cb 0.38 -2.16 -0.03 0.00 -0.11 0.00 0.00 43.42 41.49 1wuz n LEU 37 CO 0.14 0.53 0.86 0.12 -1.51 0.00 0.00 177.39 177.53 1wuz s PHE 38 N -3.64 3.46 0.02 -1.77 5.36 -1.02 -2.78 117.98 117.60 1wuz s PHE 38 Ca 0.34 1.35 -0.16 0.00 -0.96 0.00 0.00 56.93 57.49 1wuz s PHE 38 Cb -0.14 -3.39 0.03 0.00 -0.34 0.00 0.00 43.02 39.18 1wuz s PHE 38 CO 0.90 -1.14 0.36 1.03 -1.46 0.00 0.00 175.22 174.91 1wuz s ARG 39 N 0.97 0.80 -0.10 10.12 0.52 -0.06 -5.01 118.95 126.19 1wuz s ARG 39 Ca 0.58 -0.30 -0.03 0.00 -0.52 0.00 0.00 55.73 55.45 1wuz s ARG 39 Cb -0.29 0.36 -0.04 0.00 0.52 0.00 0.00 34.95 35.50 1wuz s ARG 39 CO 0.29 -0.25 0.04 0.08 0.02 0.00 0.00 175.30 175.49 1wuz s VAL 40 N -1.97 4.68 0.25 3.52 1.01 -1.26 -0.69 120.40 125.93 1wuz s VAL 40 Ca -0.09 -0.11 -0.00 0.00 0.00 0.00 0.00 61.98 61.79 1wuz s VAL 40 Cb -0.02 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.33 1wuz s VAL 40 CO 0.01 0.61 0.22 0.00 0.00 0.00 0.00 175.10 175.94 1wuz s ALA 41 N -0.91 1.19 0.11 5.51 0.00 0.43 -4.82 121.76 123.27 1wuz s ALA 41 Ca 0.14 -1.71 -0.23 0.00 0.00 0.00 0.00 51.96 50.16 1wuz s ALA 41 Cb -0.12 1.37 0.06 0.00 0.00 0.00 0.00 23.12 24.43 1wuz s ALA 41 CO 0.03 -0.65 0.56 -1.54 0.00 0.00 0.00 175.76 174.16 1wuz s SER 42 N -3.21 -0.50 -0.05 0.00 1.04 -1.26 -1.81 113.70 107.91 1wuz s SER 42 Ca 0.37 0.05 0.11 0.00 0.48 0.00 0.00 55.95 56.96 1wuz s SER 42 Cb 0.05 0.56 0.39 0.00 0.10 0.00 0.00 66.02 67.11 1wuz s SER 42 CO 0.16 -0.87 1.26 0.29 0.98 0.00 0.00 173.24 175.06 1wuz n LYS 43 N -0.09 2.39 0.00 4.02 5.02 -1.26 -4.02 118.16 124.22 1wuz n LYS 43 Ca -0.17 -1.56 0.00 0.00 -2.02 0.00 0.00 58.31 54.56 1wuz n LYS 43 Cb 0.63 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 1wuz n LYS 43 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1wuz n ASP 44 N 0.56 0.00 0.00 4.39 8.00 -1.26 -4.98 116.55 123.26 1wuz n ASP 44 Ca 0.14 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.64 1wuz n ASP 44 Cb 0.50 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 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 -1.40 1.47 -0.95 -1.24 3.00 -1.26 -5.00 116.66 111.27 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 -0.88 0.00 0.00 0.00 0.00 0.00 32.46 31.58 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 2.10 0.29 2.26 5.14 0.00 -1.26 -4.89 105.19 108.84 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 1.22 0.00 0.00 0.00 173.32 174.54 1wuz n ASP 47 N -0.41 1.05 -0.07 1.61 8.00 -1.26 -4.59 116.55 120.87 1wuz n ASP 47 Ca 0.00 -2.92 -0.11 0.00 0.71 0.00 0.00 54.79 52.48 1wuz n ASP 47 Cb 0.21 -0.64 -0.06 0.00 -0.02 0.00 0.00 41.12 40.61 1wuz n ASP 47 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wuz n LEU 48 N 1.02 2.59 -3.94 0.64 -0.00 -1.26 -4.60 117.00 111.46 1wuz n LEU 48 Ca 0.24 -0.02 -0.10 0.00 -0.00 0.00 0.00 56.01 56.13 1wuz n LEU 48 Cb 0.53 -0.48 -0.06 0.00 -0.00 0.00 0.00 43.42 43.41 1wuz n LEU 48 CO 0.23 0.65 0.03 -0.76 -0.00 0.00 0.00 177.39 177.54 1wuz s LEU 49 N -6.02 0.78 0.01 1.47 1.02 -1.26 -1.72 118.68 112.96 1wuz s LEU 49 Ca -0.19 -0.83 -0.00 0.00 0.02 0.00 0.00 54.13 53.12 1wuz s LEU 49 Cb 0.05 1.36 -0.01 0.00 0.02 0.00 0.00 46.19 47.61 1wuz s LEU 49 CO 0.31 -0.94 -0.01 -0.70 0.02 0.00 0.00 176.35 175.04 1wuz s GLU 50 N -3.96 0.18 -0.06 1.70 2.56 -1.10 -4.87 118.70 113.15 1wuz s GLU 50 Ca 0.17 -0.32 -0.03 0.00 0.00 0.00 0.00 54.97 54.79 1wuz s GLU 50 Cb 0.02 0.07 -0.04 0.00 2.00 0.00 0.00 34.13 36.18 1wuz s GLU 50 CO 0.01 -0.03 0.11 0.54 -0.56 0.00 0.00 175.26 175.33 1wuz s VAL 51 N -0.79 5.07 -0.28 3.70 0.11 -1.26 -1.32 120.40 125.63 1wuz s VAL 51 Ca -0.09 -0.12 -0.08 0.00 -2.93 0.00 0.00 61.98 58.76 1wuz s VAL 51 Cb -0.05 -3.26 -0.01 0.00 -1.53 0.00 0.00 36.38 31.52 1wuz s VAL 51 CO -0.00 0.48 0.10 0.21 -3.33 0.00 0.00 175.10 172.56 1wuz s ASN 52 N -1.40 5.28 0.30 3.54 2.47 -0.94 -4.95 114.94 119.24 1wuz s ASN 52 Ca 0.20 -0.44 0.22 0.00 0.42 0.00 0.00 52.86 53.26 1wuz s ASN 52 Cb -0.12 -1.94 1.10 0.00 -1.45 0.00 0.00 41.25 38.83 1wuz s ASN 52 CO 0.10 -0.13 1.67 0.18 -3.72 0.00 0.00 177.10 175.20 1wuz n LEU 53 N 4.93 0.59 0.13 3.21 4.32 -1.26 -0.02 117.00 128.91 1wuz n LEU 53 Ca -0.15 0.73 -0.16 0.00 -0.02 0.00 0.00 56.01 56.41 1wuz n LEU 53 Cb 0.50 -0.75 -0.09 0.00 -1.62 0.00 0.00 43.42 41.46 1wuz n LEU 53 CO 0.32 -0.82 0.51 -0.61 -1.22 0.00 0.00 177.39 175.58 1wuz h GLN 54 N 0.00 -0.72 0.00 3.23 5.75 -1.93 -3.35 115.11 118.09 1wuz h GLN 54 Ca 0.00 0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.55 1wuz h GLN 54 Cb 0.12 0.16 -0.00 0.00 1.07 0.00 0.00 27.48 28.83 1wuz h GLN 54 CO 0.00 -0.48 -1.15 0.09 -2.65 0.00 0.00 178.83 174.64 1wuz n ASN 55 N -5.26 4.25 0.00 -0.69 4.13 -1.18 -5.02 115.26 111.49 1wuz n ASN 55 Ca -0.08 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.18 1wuz n ASN 55 Cb 0.39 1.14 0.00 0.00 -1.54 0.00 0.00 39.78 39.77 1wuz n ASN 55 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1wuz n GLY 56 N 2.33 2.19 3.76 7.41 0.00 0.97 -5.04 105.19 116.81 1wuz n GLY 56 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.39 3.97 -0.00 -0.61 -1.09 -1.24 -3.53 121.20 116.30 1wuz s ILE 57 Ca 0.00 1.91 -0.01 0.00 -2.23 0.00 0.00 60.65 60.33 1wuz s ILE 57 Cb 0.00 -4.19 -0.04 0.00 -1.58 0.00 0.00 42.46 36.65 1wuz s ILE 57 CO 0.00 0.41 0.10 -1.48 -1.23 0.00 0.00 174.94 172.73 1wuz s LEU 58 N -1.41 3.98 0.38 2.97 2.34 -1.26 -2.22 118.68 123.46 1wuz s LEU 58 Ca 0.44 0.18 0.08 0.00 0.06 0.00 0.00 54.13 54.88 1wuz s LEU 58 Cb -0.26 -2.34 -0.05 0.00 -0.56 0.00 0.00 46.19 42.98 1wuz s LEU 58 CO 0.32 0.27 0.17 0.72 -1.06 0.00 0.00 176.35 176.77 1wuz s PHE 59 N -1.22 2.64 0.40 3.48 -0.71 -0.43 -1.52 117.98 120.61 1wuz s PHE 59 Ca 0.24 -0.50 -0.26 0.00 -1.04 0.00 0.00 56.93 55.37 1wuz s PHE 59 Cb -0.12 -1.83 -0.09 0.00 -1.21 0.00 0.00 43.02 39.77 1wuz s PHE 59 CO 0.15 0.24 1.26 0.08 -1.34 0.00 0.00 175.22 175.60 1wuz s VAL 60 N -2.52 2.80 -0.01 -2.49 1.01 -0.31 -2.71 120.40 116.16 1wuz s VAL 60 Ca 0.40 0.71 0.02 0.00 0.00 0.00 0.00 61.98 63.11 1wuz s VAL 60 Cb 0.01 -3.42 0.03 0.00 0.00 0.00 0.00 36.38 33.00 1wuz s VAL 60 CO 0.23 0.10 1.00 -3.20 0.00 0.00 0.00 175.10 173.22 1wuz n ASN 61 N 0.16 0.23 -2.38 3.32 2.85 -0.70 -2.30 115.26 116.43 1wuz n ASN 61 Ca 0.04 -2.07 -0.07 0.00 -0.11 0.00 0.00 54.58 52.36 1wuz n ASN 61 Cb 0.44 -0.21 0.02 0.00 1.24 0.00 0.00 39.78 41.27 1wuz n ASN 61 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1wuz n SER 62 N -0.14 -1.71 -4.68 1.20 7.64 -0.82 -4.56 113.62 110.54 1wuz n SER 62 Ca 0.01 -2.25 -0.42 0.00 1.01 0.00 0.00 58.87 57.23 1wuz n SER 62 Cb 0.69 2.87 -0.03 0.00 -1.01 0.00 0.00 64.21 66.73 1wuz n SER 62 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1wuz s ARG 63 N -2.11 4.31 -0.01 1.43 3.00 -1.26 -4.65 118.95 119.65 1wuz s ARG 63 Ca 0.13 1.77 0.13 0.00 0.00 0.00 0.00 55.73 57.76 1wuz s ARG 63 Cb -0.04 -3.61 -0.18 0.00 0.00 0.00 0.00 34.95 31.12 1wuz s ARG 63 CO 0.10 -0.54 0.32 -0.89 0.00 0.00 0.00 175.30 174.29 1wuz n ILE 64 N 4.79 0.00 -1.59 1.52 2.08 -1.26 -4.21 119.36 120.69 1wuz n ILE 64 Ca 0.12 -0.27 -0.44 0.00 0.56 0.00 0.00 62.75 62.72 1wuz n ILE 64 Cb 0.45 0.37 -0.01 0.00 -0.75 0.00 0.00 39.64 39.70 1wuz n ILE 64 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1wuz n ASP 65 N -1.80 1.30 -0.28 4.38 9.92 -1.26 -3.17 116.55 125.63 1wuz n ASP 65 Ca -0.01 1.17 0.22 0.00 -0.53 0.00 0.00 54.79 55.64 1wuz n ASP 65 Cb 0.30 -1.30 0.54 0.00 -0.64 0.00 0.00 41.12 40.02 1wuz n ASP 65 CO 0.00 0.00 0.00 0.08 0.13 0.00 0.00 177.20 177.41 1wuz h ARG 66 N 1.95 0.34 -0.48 -1.24 0.11 -1.95 0.50 114.38 113.60 1wuz h ARG 66 Ca -0.40 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.66 1wuz h ARG 66 Cb 1.34 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 32.32 1wuz h ARG 66 CO 0.60 0.22 0.31 1.05 0.10 0.00 0.00 179.97 182.26 1wuz h GLU 67 N 0.35 0.64 0.00 0.08 4.11 -1.87 0.32 114.58 118.20 1wuz h GLU 67 Ca 0.53 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.89 1wuz h GLU 67 Cb 1.43 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.53 1wuz h GLU 67 CO -0.20 0.44 -0.19 0.93 0.07 0.00 0.00 179.01 180.06 1wuz h GLU 68 N 0.65 0.00 0.00 1.06 3.07 -1.19 -3.41 114.58 114.77 1wuz h GLU 68 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 1wuz h GLU 68 Cb -0.06 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.85 1wuz h GLU 68 CO -0.04 0.33 0.00 1.28 -1.40 0.00 0.00 179.01 179.19 1wuz n LEU 69 N -4.68 0.00 0.08 1.33 4.77 0.15 -4.90 117.00 113.75 1wuz n LEU 69 Ca -0.06 0.75 0.00 0.00 -0.03 0.00 0.00 56.01 56.67 1wuz n LEU 69 Cb 0.22 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1wuz n LEU 69 CO 0.12 -0.25 0.00 0.00 -1.33 0.00 0.00 177.39 175.92 1wuz n GLY 71 N -1.25 0.70 0.00 0.00 0.00 0.10 -4.75 105.19 99.99 1wuz n GLY 71 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.88 0.00 -4.13 1.61 3.00 -1.26 -4.94 116.66 110.05 1wuz n ARG 72 Ca -0.06 0.26 -0.29 0.00 -0.01 0.00 0.00 57.85 57.75 1wuz n ARG 72 Cb 0.45 -0.83 -0.07 0.00 0.00 0.00 0.00 32.46 32.01 1wuz n ARG 72 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1wuz s SER 73 N -2.04 5.07 0.53 0.55 0.15 -1.26 -4.98 113.70 111.72 1wuz s SER 73 Ca 0.00 -0.21 0.30 0.00 0.70 0.00 0.00 55.95 56.74 1wuz s SER 73 Cb 0.00 -1.21 1.46 0.00 -1.71 0.00 0.00 66.02 64.57 1wuz s SER 73 CO 0.00 0.14 1.90 0.00 1.20 0.00 0.00 173.24 176.48 1wuz h ALA 74 N 3.11 2.79 -3.18 5.45 0.00 -1.87 -3.33 119.26 122.23 1wuz h ALA 74 Ca -0.47 -0.03 -0.70 0.00 0.00 0.00 0.00 54.91 53.71 1wuz h ALA 74 Cb 1.18 0.06 -0.32 0.00 0.00 0.00 0.00 17.79 18.71 1wuz h ALA 74 CO 0.60 -1.03 -0.59 -1.21 0.00 0.00 0.00 179.25 177.02 1wuz s GLU 75 N -4.99 2.37 -0.18 0.00 2.02 -1.26 -4.21 118.70 112.45 1wuz s GLU 75 Ca -0.05 -1.46 -0.03 0.00 0.02 0.00 0.00 54.97 53.46 1wuz s GLU 75 Cb 0.21 -3.48 -0.02 0.00 0.10 0.00 0.00 34.13 30.95 1wuz s GLU 75 CO 0.77 -0.83 -0.07 0.00 0.02 0.00 0.00 175.26 175.15 1wuz s SER 77 N 0.87 6.43 0.01 0.00 1.04 -1.26 -2.44 113.70 118.34 1wuz s SER 77 Ca -0.02 0.45 0.03 0.00 0.48 0.00 0.00 55.95 56.89 1wuz s SER 77 Cb -0.15 -2.04 -0.01 0.00 0.10 0.00 0.00 66.02 63.92 1wuz s SER 77 CO 0.01 0.21 -0.10 -0.63 0.98 0.00 0.00 173.24 173.71 1wuz s ILE 78 N -1.40 0.75 -0.02 -1.02 1.09 -0.58 -5.02 121.20 115.01 1wuz s ILE 78 Ca 0.31 -0.55 0.05 0.00 -1.10 0.00 0.00 60.65 59.36 1wuz s ILE 78 Cb -0.13 -0.66 -0.03 0.00 -1.06 0.00 0.00 42.46 40.59 1wuz s ILE 78 CO 0.20 0.11 -0.15 -1.00 -0.10 0.00 0.00 174.94 174.00 1wuz s HIS 79 N -0.43 2.65 0.04 3.97 3.76 -1.26 -1.81 115.29 122.21 1wuz s HIS 79 Ca 0.02 -0.19 -0.04 0.00 -0.15 0.00 0.00 55.06 54.70 1wuz s HIS 79 Cb -0.05 -1.57 -0.02 0.00 1.11 0.00 0.00 32.58 32.05 1wuz s HIS 79 CO -0.00 0.21 0.05 -1.17 -0.85 0.00 0.00 174.74 172.98 1wuz s LEU 80 N -0.99 2.00 -0.21 0.89 0.20 0.80 -4.84 118.68 116.53 1wuz s LEU 80 Ca 0.13 -0.61 0.01 0.00 0.69 0.00 0.00 54.13 54.35 1wuz s LEU 80 Cb -0.11 0.45 0.05 0.00 -0.43 0.00 0.00 46.19 46.15 1wuz s LEU 80 CO 0.02 -0.49 -0.11 -1.61 -0.29 0.00 0.00 176.35 173.87 1wuz s GLU 81 N -2.66 2.12 -0.44 1.98 8.01 -0.75 -2.37 118.70 124.59 1wuz s GLU 81 Ca -0.05 -0.96 -0.21 0.00 0.01 0.00 0.00 54.97 53.77 1wuz s GLU 81 Cb -0.01 -2.54 0.03 0.00 -4.31 0.00 0.00 34.13 27.29 1wuz s GLU 81 CO -0.05 -0.45 0.66 0.08 0.01 0.00 0.00 175.26 175.51 1wuz s VAL 82 N 1.33 4.80 0.12 2.63 1.01 -1.05 -0.43 120.40 128.81 1wuz s VAL 82 Ca -0.03 0.13 -0.27 0.00 0.00 0.00 0.00 61.98 61.81 1wuz s VAL 82 Cb -0.17 -4.23 -0.07 0.00 0.00 0.00 0.00 36.38 31.91 1wuz s VAL 82 CO -0.08 -0.63 0.85 -0.51 0.00 0.00 0.00 175.10 174.73 1wuz s ILE 83 N 2.89 4.48 -0.07 2.22 -1.16 0.13 -1.38 121.20 128.32 1wuz s ILE 83 Ca 0.23 1.84 -0.04 0.00 -0.51 0.00 0.00 60.65 62.17 1wuz s ILE 83 Cb -0.14 -4.21 0.03 0.00 0.61 0.00 0.00 42.46 38.75 1wuz s ILE 83 CO 0.19 0.41 0.16 0.68 -2.81 0.00 0.00 174.94 173.57 1wuz s VAL 84 N -0.47 -0.03 -0.28 4.00 -7.23 -0.95 -0.88 120.40 114.56 1wuz s VAL 84 Ca 0.41 0.11 -0.11 0.00 -1.81 0.00 0.00 61.98 60.58 1wuz s VAL 84 Cb -0.23 -0.24 -0.04 0.00 0.56 0.00 0.00 36.38 36.43 1wuz s VAL 84 CO 0.27 0.05 0.18 -0.62 -0.31 0.00 0.00 175.10 174.66 1wuz s ASP 85 N 0.79 5.88 -0.23 4.85 2.15 -0.64 -2.55 116.67 126.92 1wuz s ASP 85 Ca -0.06 -0.10 -0.06 0.00 0.43 0.00 0.00 52.55 52.76 1wuz s ASP 85 Cb -0.08 -2.09 0.01 0.00 -0.30 0.00 0.00 42.92 40.46 1wuz s ASP 85 CO -0.04 -0.07 0.22 -1.14 -0.17 0.00 0.00 175.17 173.96 1wuz n ARG 86 N 5.04 -1.76 -1.49 4.34 0.63 -1.26 -3.91 116.66 118.25 1wuz n ARG 86 Ca -0.14 1.67 -0.32 0.00 -0.92 0.00 0.00 57.85 58.14 1wuz n ARG 86 Cb 0.52 -3.92 0.07 0.00 0.45 0.00 0.00 32.46 29.57 1wuz n ARG 86 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1wuz s PRO 87 N -1.58 2.51 -0.52 -0.14 0.04 -1.26 -4.68 135.00 129.36 1wuz s PRO 87 Ca 0.09 1.28 -0.20 0.00 0.04 0.00 0.00 61.00 62.20 1wuz s PRO 87 Cb -0.03 -1.92 0.06 0.00 0.04 0.00 0.00 34.50 32.65 1wuz s PRO 87 CO 0.48 -1.46 0.70 -0.51 0.04 0.00 0.00 177.00 176.24 1wuz s LEU 88 N -5.42 4.82 0.00 -3.56 1.02 -1.25 -4.66 118.68 109.62 1wuz s LEU 88 Ca 0.64 -0.85 -0.15 0.00 0.02 0.00 0.00 54.13 53.79 1wuz s LEU 88 Cb -0.19 -2.50 0.05 0.00 0.02 0.00 0.00 46.19 43.57 1wuz s LEU 88 CO 0.49 -0.98 0.69 0.00 0.02 0.00 0.00 176.35 176.57 1wuz n GLN 89 N 6.46 0.01 -4.39 1.70 1.13 -1.06 -5.05 117.38 116.17 1wuz n GLN 89 Ca -0.05 -0.27 -0.24 0.00 -1.94 0.00 0.00 57.00 54.51 1wuz n GLN 89 Cb 0.46 0.52 -0.11 0.00 0.11 0.00 0.00 30.24 31.21 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 -2.01 2.13 -0.11 5.09 1.01 -1.26 -2.24 120.40 123.02 1wuz s VAL 90 Ca 0.16 -2.09 0.00 0.00 0.00 0.00 0.00 61.98 60.06 1wuz s VAL 90 Cb -0.00 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 1wuz s VAL 90 CO -0.01 -0.29 -0.11 -0.36 0.00 0.00 0.00 175.10 174.32 1wuz s PHE 91 N -2.10 2.84 -0.41 5.22 0.08 -0.48 -4.92 117.98 118.21 1wuz s PHE 91 Ca 0.21 -0.40 -0.29 0.00 0.12 0.00 0.00 56.93 56.57 1wuz s PHE 91 Cb -0.06 -1.80 0.01 0.00 -0.57 0.00 0.00 43.02 40.60 1wuz s PHE 91 CO 0.09 -0.03 1.39 -1.58 -0.10 0.00 0.00 175.22 174.99 1wuz s HIS 92 N -0.03 2.44 -0.13 0.36 2.46 -0.46 -2.53 115.29 117.40 1wuz s HIS 92 Ca -0.02 0.69 0.03 0.00 0.47 0.00 0.00 55.06 56.22 1wuz s HIS 92 Cb -0.14 -4.30 0.01 0.00 -0.13 0.00 0.00 32.58 28.02 1wuz s HIS 92 CO 0.04 -1.92 -0.22 0.08 -2.47 0.00 0.00 174.74 170.25 1wuz s VAL 93 N 5.31 2.14 -0.17 0.89 1.01 -1.00 -1.60 120.40 126.98 1wuz s VAL 93 Ca 0.60 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 1wuz s VAL 93 Cb -0.13 -1.85 0.04 0.00 0.00 0.00 0.00 36.38 34.44 1wuz s VAL 93 CO 0.32 0.55 -0.04 -1.61 0.00 0.00 0.00 175.10 174.32 1wuz s GLU 94 N 0.67 1.36 -0.15 2.72 2.02 -0.32 -0.14 118.70 124.85 1wuz s GLU 94 Ca -0.10 -0.52 -0.05 0.00 0.02 0.00 0.00 54.97 54.32 1wuz s GLU 94 Cb -0.16 -2.02 -0.03 0.00 0.10 0.00 0.00 34.13 32.01 1wuz s GLU 94 CO 0.02 -0.46 0.00 0.14 0.02 0.00 0.00 175.26 174.98 1wuz s VAL 95 N 1.65 4.25 0.15 2.63 -7.23 -0.75 -1.60 120.40 119.50 1wuz s VAL 95 Ca 0.00 -0.23 0.06 0.00 -1.81 0.00 0.00 61.98 60.00 1wuz s VAL 95 Cb -0.16 -2.87 -0.04 0.00 0.56 0.00 0.00 36.38 33.87 1wuz s VAL 95 CO -0.08 0.50 0.05 -1.61 -0.31 0.00 0.00 175.10 173.65 1wuz s GLU 96 N 0.19 2.63 -0.20 4.82 2.02 -1.11 -1.53 118.70 125.51 1wuz s GLU 96 Ca 0.01 -0.95 -0.08 0.00 0.02 0.00 0.00 54.97 53.97 1wuz s GLU 96 Cb -0.13 -2.51 -0.04 0.00 0.10 0.00 0.00 34.13 31.54 1wuz s GLU 96 CO 0.02 0.49 0.09 0.14 0.02 0.00 0.00 175.26 176.02 1wuz s VAL 97 N -1.63 4.90 -0.36 2.63 -7.23 -1.02 -2.64 120.40 115.05 1wuz s VAL 97 Ca 0.28 0.01 -0.17 0.00 -1.81 0.00 0.00 61.98 60.29 1wuz s VAL 97 Cb -0.10 -3.24 -0.00 0.00 0.56 0.00 0.00 36.38 33.60 1wuz s VAL 97 CO 0.20 0.42 0.46 -0.60 -0.31 0.00 0.00 175.10 175.28 1wuz s ARG 98 N 0.64 3.51 0.00 4.82 6.06 -1.03 -4.34 118.95 128.61 1wuz s ARG 98 Ca 0.05 -0.34 0.00 0.00 -2.50 0.00 0.00 55.73 52.94 1wuz s ARG 98 Cb -0.13 -3.84 0.00 0.00 0.06 0.00 0.00 34.95 31.05 1wuz s ARG 98 CO 0.01 -0.65 0.00 -0.25 -2.50 0.00 0.00 175.30 171.91 1wuz n ASP 99 N 5.64 0.00 -4.36 -2.12 9.92 -1.26 -2.54 116.55 121.83 1wuz n ASP 99 Ca -0.06 0.00 -0.22 0.00 -0.53 0.00 0.00 54.79 53.98 1wuz n ASP 99 Cb 0.49 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.86 1wuz n ASP 99 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1wuz s ILE 100 N -2.73 1.94 -0.13 0.53 1.09 -1.26 -4.68 121.20 115.95 1wuz s ILE 100 Ca 0.00 -2.03 -0.22 0.00 -1.10 0.00 0.00 60.65 57.30 1wuz s ILE 100 Cb 0.00 -1.96 -0.26 0.00 -1.06 0.00 0.00 42.46 39.19 1wuz s ILE 100 CO 0.00 -0.35 0.61 -1.13 -0.10 0.00 0.00 174.94 173.97 1wuz h ASN 101 N 3.03 0.18 -0.48 3.58 -1.24 -1.88 -3.32 115.58 115.45 1wuz h ASN 101 Ca -0.42 -0.84 0.14 0.00 0.71 0.00 0.00 56.30 55.89 1wuz h ASN 101 Cb 1.21 -0.06 -0.02 0.00 0.73 0.00 0.00 38.32 40.19 1wuz h ASN 101 CO 0.53 1.35 0.38 -0.78 -1.29 0.00 0.00 177.43 177.62 1wuz h ASP 102 N -0.70 0.00 0.00 1.15 3.58 -1.97 -3.48 116.42 114.99 1wuz h ASP 102 Ca -0.19 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.26 1wuz h ASP 102 Cb 1.39 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.44 1wuz h ASP 102 CO -0.01 0.00 0.00 -3.20 -2.88 0.00 0.00 179.24 173.15