#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 6.04 0.00 1.61 0.01 -1.26 -5.00 114.94 116.34 1wuz s ASN 2 Ca 0.00 0.94 0.00 0.00 -0.71 0.00 0.00 52.86 53.09 1wuz s ASN 2 Cb 0.00 -2.11 0.00 0.00 0.41 0.00 0.00 41.25 39.55 1wuz s ASN 2 CO 0.00 -0.79 0.00 -1.20 -1.51 0.00 0.00 177.10 173.60 1wuz n SER 3 N -2.45 0.00 -4.57 -1.22 7.64 -1.26 -5.01 113.62 106.76 1wuz n SER 3 Ca 0.03 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.48 1wuz n SER 3 Cb 0.56 0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.76 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 -1.31 3.51 0.01 1.43 -0.21 -1.26 -1.59 119.66 120.24 1wuz s GLN 4 Ca 0.00 0.16 0.04 0.00 0.02 0.00 0.00 55.36 55.58 1wuz s GLN 4 Cb 0.00 -3.99 -0.01 0.00 1.00 0.00 0.00 33.01 30.01 1wuz s GLN 4 CO 0.00 -1.49 -0.13 0.42 -2.12 0.00 0.00 175.29 171.97 1wuz s ILE 5 N 4.37 1.04 0.03 1.08 -1.09 -0.09 -5.02 121.20 121.52 1wuz s ILE 5 Ca 0.39 -0.68 0.00 0.00 -2.23 0.00 0.00 60.65 58.13 1wuz s ILE 5 Cb -0.09 -0.89 -0.02 0.00 -1.58 0.00 0.00 42.46 39.88 1wuz s ILE 5 CO 0.25 0.20 -0.04 -1.38 -1.23 0.00 0.00 174.94 172.74 1wuz s HIS 6 N -0.47 0.34 0.39 3.97 -3.43 -1.26 -1.10 115.29 113.73 1wuz s HIS 6 Ca 0.04 -0.57 0.05 0.00 -0.80 0.00 0.00 55.06 53.78 1wuz s HIS 6 Cb -0.06 -0.23 -0.06 0.00 -1.43 0.00 0.00 32.58 30.79 1wuz s HIS 6 CO 0.00 -0.19 0.03 0.71 -2.00 0.00 0.00 174.74 173.29 1wuz s TYR 7 N -1.64 2.22 -0.04 0.38 2.02 0.39 -4.89 117.35 115.78 1wuz s TYR 7 Ca -0.13 -0.84 0.03 0.00 -0.37 0.00 0.00 57.07 55.76 1wuz s TYR 7 Cb -0.09 -1.55 0.00 0.00 -0.40 0.00 0.00 41.96 39.93 1wuz s TYR 7 CO -0.01 0.23 -0.14 -1.54 -1.57 0.00 0.00 175.55 172.52 1wuz s SER 8 N -3.64 1.79 -0.20 2.29 1.04 -0.99 -2.71 113.70 111.29 1wuz s SER 8 Ca 0.32 -0.29 -0.08 0.00 0.48 0.00 0.00 55.95 56.38 1wuz s SER 8 Cb 0.08 -0.58 0.08 0.00 0.10 0.00 0.00 66.02 65.70 1wuz s SER 8 CO 0.15 0.10 0.45 -0.51 0.98 0.00 0.00 173.24 174.41 1wuz s ILE 9 N 0.25 -0.46 0.24 -1.02 2.07 -1.06 -4.45 121.20 116.77 1wuz s ILE 9 Ca -0.07 0.13 -0.30 0.00 -1.41 0.00 0.00 60.65 59.00 1wuz s ILE 9 Cb -0.12 -0.69 -0.09 0.00 0.13 0.00 0.00 42.46 41.69 1wuz s ILE 9 CO 0.02 0.05 1.28 -2.16 -1.91 0.00 0.00 174.94 172.22 1wuz s PRO 10 N 2.23 4.42 1.01 3.50 0.04 -1.26 -2.47 135.00 142.46 1wuz s PRO 10 Ca -0.05 2.05 -0.17 0.00 0.04 0.00 0.00 61.00 62.87 1wuz s PRO 10 Cb -0.11 -3.17 -0.02 0.00 0.04 0.00 0.00 34.50 31.25 1wuz s PRO 10 CO -0.14 -0.17 -0.19 0.39 0.04 0.00 0.00 177.00 176.94 1wuz n GLU 11 N 2.03 -0.51 -1.62 4.56 1.02 -0.94 -2.67 120.64 122.52 1wuz n GLU 11 Ca 0.04 -0.13 -0.16 0.00 -0.02 0.00 0.00 57.16 56.89 1wuz n GLU 11 Cb 0.43 -1.53 -0.06 0.00 -0.02 0.00 0.00 31.44 30.26 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 -0.37 -1.17 -2.11 3.49 2.13 -0.84 -4.86 120.64 116.91 1wuz n GLU 12 Ca 0.02 1.03 -0.42 0.00 0.66 0.00 0.00 57.16 58.46 1wuz n GLU 12 Cb 0.59 -5.27 -0.03 0.00 0.27 0.00 0.00 31.44 27.00 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 -2.65 2.78 0.66 4.31 0.00 -1.09 -4.75 121.76 121.03 1wuz s ALA 13 Ca 0.00 -0.05 -0.17 0.00 0.00 0.00 0.00 51.96 51.74 1wuz s ALA 13 Cb 0.00 -4.05 -0.00 0.00 0.00 0.00 0.00 23.12 19.07 1wuz s ALA 13 CO 0.00 -2.82 1.22 -1.59 0.00 0.00 0.00 175.76 172.57 1wuz s LYS 14 N 5.73 2.56 -0.06 0.00 0.00 -1.26 -4.30 119.74 122.41 1wuz s LYS 14 Ca 0.72 1.83 -0.36 0.00 0.00 0.00 0.00 55.97 58.15 1wuz s LYS 14 Cb -0.18 -1.88 -0.14 0.00 0.00 0.00 0.00 37.83 35.63 1wuz s LYS 14 CO 0.31 -1.53 1.68 0.72 0.00 0.00 0.00 175.35 176.53 1wuz n HIS 15 N -2.13 2.08 0.00 1.78 8.25 -1.26 -1.71 115.22 122.23 1wuz n HIS 15 Ca 0.14 0.33 0.00 0.00 -0.26 0.00 0.00 57.72 57.93 1wuz n HIS 15 Cb 0.50 -2.52 0.00 0.00 1.12 0.00 0.00 29.99 29.09 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 3.78 0.99 3.79 -1.41 0.00 -0.86 -4.87 105.19 106.61 1wuz n GLY 16 Ca 0.22 0.00 -0.37 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 4.35 0.13 2.61 2.01 -0.69 -4.67 115.64 117.37 1wuz s THR 17 Ca 0.00 1.64 -0.31 0.00 0.31 0.00 0.00 61.69 63.33 1wuz s THR 17 Cb 0.00 -3.99 -0.08 0.00 0.01 0.00 0.00 72.50 68.44 1wuz s THR 17 CO 0.00 0.22 1.34 0.12 -0.69 0.00 0.00 174.62 175.61 1wuz s PHE 18 N -1.51 3.28 -0.04 4.92 5.36 -1.26 -2.42 117.98 126.31 1wuz s PHE 18 Ca 0.46 1.08 -0.05 0.00 -0.96 0.00 0.00 56.93 57.46 1wuz s PHE 18 Cb -0.19 -3.62 -0.03 0.00 -0.34 0.00 0.00 43.02 38.85 1wuz s PHE 18 CO 0.23 -2.06 -0.11 0.28 -1.46 0.00 0.00 175.22 172.10 1wuz n VAL 19 N 3.61 0.86 -3.74 3.12 0.31 -0.44 -4.79 118.33 117.27 1wuz n VAL 19 Ca 0.10 0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1wuz n VAL 19 Cb 0.43 -1.71 -0.00 0.00 -0.91 0.00 0.00 33.84 31.65 1wuz n VAL 19 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1wuz s GLY 20 N -4.76 -0.27 -0.86 2.92 0.00 -1.26 -2.35 107.32 100.74 1wuz s GLY 20 Ca -0.11 0.36 -0.13 0.00 0.00 0.00 0.00 44.72 44.84 1wuz s GLY 20 CO 0.15 1.31 0.80 0.50 0.00 0.00 0.00 173.10 175.85 1wuz s ARG 21 N -2.48 3.65 0.14 2.90 3.00 -1.26 -1.33 118.95 123.56 1wuz s ARG 21 Ca 0.17 -2.56 -0.14 0.00 0.00 0.00 0.00 55.73 53.20 1wuz s ARG 21 Cb 0.02 -4.42 0.01 0.00 0.00 0.00 0.00 34.95 30.56 1wuz s ARG 21 CO -0.01 -1.28 1.64 0.97 0.00 0.00 0.00 175.30 176.62 1wuz h ILE 22 N 4.65 1.24 -0.35 1.52 2.10 -1.91 -1.07 117.51 123.70 1wuz h ILE 22 Ca 0.11 -0.83 -0.13 0.00 1.08 0.00 0.00 64.86 65.09 1wuz h ILE 22 Cb 1.02 0.92 -0.01 0.00 -1.09 0.00 0.00 36.82 37.66 1wuz h ILE 22 CO 0.78 0.29 -0.30 0.00 -1.08 0.00 0.00 178.15 177.84 1wuz h ALA 23 N 0.97 0.51 -0.66 0.18 0.00 -1.90 -1.61 119.26 116.76 1wuz h ALA 23 Ca 0.14 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1wuz h ALA 23 Cb 0.33 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1wuz h ALA 23 CO 0.00 0.55 0.33 0.37 0.00 0.00 0.00 179.25 180.50 1wuz h GLN 24 N 0.62 0.94 0.00 0.00 -0.00 -1.75 0.30 115.11 115.22 1wuz h GLN 24 Ca 0.06 -0.13 0.00 0.00 -0.00 0.00 0.00 58.65 58.58 1wuz h GLN 24 Cb 0.88 -0.17 0.00 0.00 0.00 0.00 0.00 27.48 28.19 1wuz h GLN 24 CO 0.08 0.73 0.00 -0.44 0.00 0.00 0.00 178.83 179.20 1wuz h ASP 25 N 0.90 0.00 0.13 -0.69 3.32 -1.16 -3.22 116.42 115.70 1wuz h ASP 25 Ca 0.23 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.92 1wuz h ASP 25 Cb 0.10 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1wuz h ASP 25 CO -0.03 0.00 -1.94 -0.07 -1.72 0.00 0.00 179.24 175.48 1wuz h LEU 26 N 0.00 0.42 -0.47 1.55 4.07 -0.40 -3.46 115.31 117.02 1wuz h LEU 26 Ca 0.00 -0.94 0.00 0.00 0.08 0.00 0.00 57.88 57.02 1wuz h LEU 26 Cb 0.63 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.23 1wuz h LEU 26 CO 0.00 1.84 0.00 0.61 -1.08 0.00 0.00 178.44 179.81 1wuz n GLY 27 N 1.96 0.92 3.02 0.83 0.00 0.99 -4.81 105.19 108.10 1wuz n GLY 27 Ca -0.31 -0.27 -0.17 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.47 2.07 0.32 0.99 0.05 -1.17 -5.08 118.68 115.38 1wuz s LEU 28 Ca 0.00 -0.24 -0.28 0.00 0.05 0.00 0.00 54.13 53.66 1wuz s LEU 28 Cb 0.00 -0.37 -0.10 0.00 -2.05 0.00 0.00 46.19 43.67 1wuz s LEU 28 CO 0.00 0.04 1.19 -0.70 -0.55 0.00 0.00 176.35 176.33 1wuz s GLU 29 N -0.52 4.43 0.66 1.48 2.12 -1.26 -4.74 118.70 120.88 1wuz s GLU 29 Ca 0.01 1.97 0.42 0.00 0.36 0.00 0.00 54.97 57.73 1wuz s GLU 29 Cb -0.05 -3.06 2.29 0.00 0.26 0.00 0.00 34.13 33.58 1wuz s GLU 29 CO 0.00 -0.03 2.32 -0.07 -0.54 0.00 0.00 175.26 176.94 1wuz h LEU 30 N 3.45 0.00 -0.99 2.70 3.38 -1.97 0.27 115.31 122.15 1wuz h LEU 30 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1wuz h LEU 30 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1wuz h LEU 30 CO 0.66 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.54 1wuz n THR 31 N -3.16 0.16 0.09 0.22 -2.24 -1.26 -3.64 114.28 104.45 1wuz n THR 31 Ca -0.03 -0.30 0.04 0.00 -2.27 0.00 0.00 64.05 61.49 1wuz n THR 31 Cb 0.11 0.32 -0.06 0.00 -2.10 0.00 0.00 70.33 68.60 1wuz n THR 31 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1wuz n GLU 32 N 0.20 1.23 -0.15 -0.78 4.07 0.94 -4.60 120.64 121.54 1wuz n GLU 32 Ca 0.16 -0.06 -0.10 0.00 -0.06 0.00 0.00 57.16 57.10 1wuz n GLU 32 Cb 0.31 -1.12 -0.01 0.00 -0.06 0.00 0.00 31.44 30.56 1wuz n GLU 32 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1wuz h LEU 33 N 0.00 0.81 0.21 4.31 4.07 -1.58 -1.30 115.31 121.82 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 0.34 -0.22 -0.04 0.00 1.08 0.00 0.00 40.66 41.82 1wuz h LEU 33 CO 0.00 0.95 -0.44 0.58 -1.08 0.00 0.00 178.44 178.45 1wuz h VAL 34 N 0.65 0.12 0.00 1.22 2.07 -1.81 -1.41 116.25 117.09 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 0.56 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 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 -0.74 0.00 -0.39 1.57 0.13 -1.82 -2.48 132.00 128.27 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 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1wuz h PRO 35 CO -0.20 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.11 1wuz n ARG 36 N -2.36 1.88 -3.78 0.86 1.74 -0.49 -4.92 116.66 109.59 1wuz n ARG 36 Ca 0.02 -1.21 -0.29 0.00 -0.77 0.00 0.00 57.85 55.60 1wuz n ARG 36 Cb 0.23 -1.33 0.02 0.00 -1.02 0.00 0.00 32.46 30.37 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 0.44 -2.63 -4.77 0.55 7.99 -0.93 -1.70 117.00 115.96 1wuz n LEU 37 Ca 0.11 -1.00 -0.40 0.00 -0.01 0.00 0.00 56.01 54.71 1wuz n LEU 37 Cb 0.33 -2.35 -0.03 0.00 -0.11 0.00 0.00 43.42 41.26 1wuz n LEU 37 CO 0.08 0.46 0.89 0.12 -1.51 0.00 0.00 177.39 177.44 1wuz s PHE 38 N -3.64 3.19 0.07 -1.77 5.36 -0.95 -2.64 117.98 117.59 1wuz s PHE 38 Ca 0.28 1.53 -0.18 0.00 -0.96 0.00 0.00 56.93 57.60 1wuz s PHE 38 Cb -0.10 -3.51 0.04 0.00 -0.34 0.00 0.00 43.02 39.11 1wuz s PHE 38 CO 0.87 -1.38 0.42 0.50 -1.46 0.00 0.00 175.22 174.17 1wuz s ARG 39 N -1.82 0.98 -0.00 10.12 6.06 0.45 -4.99 118.95 129.75 1wuz s ARG 39 Ca 0.50 -0.45 0.05 0.00 -2.50 0.00 0.00 55.73 53.33 1wuz s ARG 39 Cb -0.35 0.44 -0.01 0.00 0.06 0.00 0.00 34.95 35.08 1wuz s ARG 39 CO 0.46 -0.35 -0.15 0.08 -2.50 0.00 0.00 175.30 172.84 1wuz s VAL 40 N -2.87 1.18 0.01 7.11 1.01 -1.26 -0.91 120.40 124.67 1wuz s VAL 40 Ca -0.03 -0.72 -0.23 0.00 0.00 0.00 0.00 61.98 61.01 1wuz s VAL 40 Cb -0.00 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 35.43 1wuz s VAL 40 CO -0.05 0.27 0.52 0.00 0.00 0.00 0.00 175.10 175.84 1wuz s ALA 41 N -0.45 -1.33 0.07 5.51 0.00 -0.84 -4.91 121.76 119.82 1wuz s ALA 41 Ca 0.05 0.73 0.01 0.00 0.00 0.00 0.00 51.96 52.75 1wuz s ALA 41 Cb -0.06 0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 1wuz s ALA 41 CO -0.00 -0.42 -0.05 0.45 0.00 0.00 0.00 175.76 175.74 1wuz s SER 42 N -1.63 0.80 0.00 0.00 0.15 -1.26 -1.20 113.70 110.56 1wuz s SER 42 Ca -0.08 -0.91 0.31 0.00 0.70 0.00 0.00 55.95 55.97 1wuz s SER 42 Cb -0.01 0.13 1.73 0.00 -1.71 0.00 0.00 66.02 66.16 1wuz s SER 42 CO 0.03 -0.47 2.14 2.29 1.20 0.00 0.00 173.24 178.43 1wuz n LYS 43 N 0.33 0.77 0.00 5.44 -0.00 -1.26 -3.62 118.16 119.82 1wuz n LYS 43 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 1wuz n LYS 43 Cb 0.60 -1.50 0.00 0.00 -0.00 0.00 0.00 35.03 34.13 1wuz n LYS 43 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1wuz n ASP 44 N -1.11 0.00 0.00 -5.58 9.92 -1.26 -4.94 116.55 113.58 1wuz n ASP 44 Ca 0.20 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.46 1wuz n ASP 44 Cb 0.16 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.63 1wuz n ASP 44 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1wuz n ARG 45 N -1.32 1.73 -0.99 -1.24 1.74 -1.26 -5.01 116.66 110.32 1wuz n ARG 45 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1wuz n ARG 45 Cb 0.00 -0.84 0.00 0.00 -1.02 0.00 0.00 32.46 30.60 1wuz n ARG 45 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wuz n GLY 46 N 1.87 0.22 0.85 -0.13 0.00 -1.24 -4.77 105.19 101.99 1wuz n GLY 46 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.55 0.79 -0.09 1.61 2.03 -1.26 -4.54 116.55 114.53 1wuz n ASP 47 Ca 0.00 -2.29 -0.12 0.00 0.52 0.00 0.00 54.79 52.90 1wuz n ASP 47 Cb 0.28 -0.29 -0.04 0.00 -0.72 0.00 0.00 41.12 40.34 1wuz n ASP 47 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1wuz h LEU 48 N 0.48 0.53 -8.13 -2.67 4.07 -1.86 -3.38 115.31 104.35 1wuz h LEU 48 Ca -0.09 -0.38 -0.04 0.00 0.08 0.00 0.00 57.88 57.46 1wuz h LEU 48 Cb 1.52 -0.14 -0.09 0.00 1.08 0.00 0.00 40.66 43.02 1wuz h LEU 48 CO 0.04 0.78 -0.07 -0.76 -1.08 0.00 0.00 178.44 177.35 1wuz s LEU 49 N -9.30 0.26 -0.00 1.67 1.02 -1.26 -2.26 118.68 108.81 1wuz s LEU 49 Ca -0.13 -0.83 -0.10 0.00 0.02 0.00 0.00 54.13 53.08 1wuz s LEU 49 Cb 0.08 1.90 0.01 0.00 0.02 0.00 0.00 46.19 48.19 1wuz s LEU 49 CO 0.77 -1.14 0.21 -1.61 0.02 0.00 0.00 176.35 174.60 1wuz s GLU 50 N -3.99 0.56 0.07 1.70 2.02 -1.09 -4.86 118.70 113.12 1wuz s GLU 50 Ca 0.19 -0.33 -0.12 0.00 0.02 0.00 0.00 54.97 54.73 1wuz s GLU 50 Cb -0.01 0.24 -0.06 0.00 0.10 0.00 0.00 34.13 34.40 1wuz s GLU 50 CO 0.07 -0.14 0.43 0.54 0.02 0.00 0.00 175.26 176.17 1wuz s VAL 51 N -1.40 5.03 -0.19 2.63 0.11 -1.26 -1.36 120.40 123.96 1wuz s VAL 51 Ca -0.14 0.64 -0.06 0.00 -2.93 0.00 0.00 61.98 59.49 1wuz s VAL 51 Cb -0.07 -3.68 -0.03 0.00 -1.53 0.00 0.00 36.38 31.07 1wuz s VAL 51 CO 0.02 0.37 0.02 0.54 -3.33 0.00 0.00 175.10 172.73 1wuz s ASN 52 N -1.54 5.17 0.00 3.54 4.22 0.23 -4.95 114.94 121.62 1wuz s ASN 52 Ca 0.31 -0.07 0.19 0.00 -2.14 0.00 0.00 52.86 51.15 1wuz s ASN 52 Cb -0.15 -1.88 0.92 0.00 1.28 0.00 0.00 41.25 41.42 1wuz s ASN 52 CO 0.17 0.13 1.58 0.18 -2.04 0.00 0.00 177.10 177.11 1wuz n LEU 53 N 3.83 0.00 -0.06 3.54 4.32 -1.26 0.09 117.00 127.46 1wuz n LEU 53 Ca -0.17 0.32 -0.12 0.00 -0.02 0.00 0.00 56.01 56.03 1wuz n LEU 53 Cb 0.52 -0.32 -0.05 0.00 -1.62 0.00 0.00 43.42 41.94 1wuz n LEU 53 CO 0.33 -0.12 0.76 -0.61 -1.22 0.00 0.00 177.39 176.53 1wuz h GLN 54 N 0.00 0.32 0.00 3.23 4.15 -1.93 -3.36 115.11 117.52 1wuz h GLN 54 Ca 0.00 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.32 1wuz h GLN 54 Cb 0.20 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.86 1wuz h GLN 54 CO 0.00 0.52 -0.12 -1.71 -1.93 0.00 0.00 178.83 175.58 1wuz n ASN 55 N -4.73 0.61 -2.94 -0.69 2.85 -1.19 -5.00 115.26 104.17 1wuz n ASN 55 Ca -0.05 -1.64 -0.21 0.00 -0.11 0.00 0.00 54.58 52.57 1wuz n ASN 55 Cb 0.21 -0.09 0.01 0.00 1.24 0.00 0.00 39.78 41.16 1wuz n ASN 55 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1wuz n GLY 56 N -0.24 -0.51 3.75 8.20 0.00 0.11 -4.97 105.19 111.54 1wuz n GLY 56 Ca 0.02 0.08 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.01 3.40 -0.37 -0.61 1.10 -1.15 -3.45 121.20 117.11 1wuz s ILE 57 Ca 0.24 -1.63 -0.14 0.00 -0.51 0.00 0.00 60.65 58.60 1wuz s ILE 57 Cb -0.12 -3.05 0.00 0.00 0.15 0.00 0.00 42.46 39.44 1wuz s ILE 57 CO 0.30 -0.24 0.30 -0.76 -2.11 0.00 0.00 174.94 172.43 1wuz s LEU 58 N -3.84 4.75 -0.16 8.50 2.01 -0.44 -0.60 118.68 128.89 1wuz s LEU 58 Ca 0.36 -0.59 -0.07 0.00 0.01 0.00 0.00 54.13 53.85 1wuz s LEU 58 Cb -0.05 -2.20 -0.04 0.00 0.01 0.00 0.00 46.19 43.91 1wuz s LEU 58 CO 0.23 -0.36 0.07 0.72 1.01 0.00 0.00 176.35 178.02 1wuz s PHE 59 N 1.80 3.31 0.36 0.29 -0.12 -0.47 -1.33 117.98 121.82 1wuz s PHE 59 Ca 0.07 0.18 -0.26 0.00 -0.05 0.00 0.00 56.93 56.87 1wuz s PHE 59 Cb -0.18 -2.03 -0.12 0.00 -0.63 0.00 0.00 43.02 40.05 1wuz s PHE 59 CO 0.11 0.29 0.99 0.28 -0.05 0.00 0.00 175.22 176.84 1wuz n VAL 60 N 3.15 2.15 -2.65 -2.49 0.31 -1.02 -2.66 118.33 115.13 1wuz n VAL 60 Ca -0.17 -0.50 -0.00 0.00 -0.01 0.00 0.00 64.34 63.66 1wuz n VAL 60 Cb 0.53 -1.06 0.05 0.00 -0.91 0.00 0.00 33.84 32.45 1wuz n VAL 60 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1wuz n ASN 61 N 0.91 0.64 -0.92 4.52 5.15 -0.98 -2.02 115.26 122.56 1wuz n ASN 61 Ca 0.09 -2.05 0.00 0.00 -0.60 0.00 0.00 54.58 52.02 1wuz n ASN 61 Cb 0.36 -0.15 0.00 0.00 -0.53 0.00 0.00 39.78 39.46 1wuz n ASN 61 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1wuz n SER 62 N -0.46 0.00 -4.65 1.20 2.88 -0.96 -4.48 113.62 107.15 1wuz n SER 62 Ca -0.01 -0.92 -0.43 0.00 -1.33 0.00 0.00 58.87 56.18 1wuz n SER 62 Cb 0.89 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.33 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 -1.76 4.17 -0.01 -1.46 1.81 -1.26 -4.66 118.95 115.78 1wuz s ARG 63 Ca 0.00 1.39 0.13 0.00 -1.72 0.00 0.00 55.73 55.52 1wuz s ARG 63 Cb 0.00 -3.73 -0.18 0.00 -0.45 0.00 0.00 34.95 30.59 1wuz s ARG 63 CO 0.00 -0.78 0.36 -0.89 -0.68 0.00 0.00 175.30 173.31 1wuz n ILE 64 N 5.57 0.00 -1.73 1.52 2.08 -1.26 -4.16 119.36 121.38 1wuz n ILE 64 Ca 0.13 -0.26 -0.37 0.00 0.56 0.00 0.00 62.75 62.80 1wuz n ILE 64 Cb 0.46 0.47 0.06 0.00 -0.75 0.00 0.00 39.64 39.88 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 -1.72 2.16 -0.28 4.38 -0.08 -1.26 -1.99 116.55 117.75 1wuz n ASP 65 Ca -0.01 0.86 0.34 0.00 -1.51 0.00 0.00 54.79 54.47 1wuz n ASP 65 Cb 0.28 -1.55 0.74 0.00 2.34 0.00 0.00 41.12 42.93 1wuz n ASP 65 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 1wuz h ARG 66 N 0.75 0.00 0.01 -0.67 0.11 -1.95 0.44 114.38 113.08 1wuz h ARG 66 Ca -0.51 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.58 1wuz h ARG 66 Cb 1.33 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.40 1wuz h ARG 66 CO 0.54 0.00 -0.11 0.93 0.10 0.00 0.00 179.97 181.42 1wuz h GLU 67 N 0.00 -0.15 0.19 0.08 5.08 -1.89 0.45 114.58 118.34 1wuz h GLU 67 Ca 0.53 0.01 -0.33 0.00 -1.00 0.00 0.00 59.36 58.57 1wuz h GLU 67 Cb 2.17 0.03 0.01 0.00 0.50 0.00 0.00 28.75 31.47 1wuz h GLU 67 CO -0.01 -0.10 -1.58 0.93 -1.00 0.00 0.00 179.01 177.26 1wuz h GLU 68 N -0.15 0.40 0.00 2.33 4.39 -1.73 -3.39 114.58 116.42 1wuz h GLU 68 Ca 0.00 -0.68 0.00 0.00 0.34 0.00 0.00 59.36 59.02 1wuz h GLU 68 Cb 0.16 0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1wuz h GLU 68 CO -0.07 1.30 0.00 -0.11 -1.16 0.00 0.00 179.01 178.97 1wuz n LEU 69 N -3.59 0.00 0.10 1.33 -0.00 0.15 -4.87 117.00 110.13 1wuz n LEU 69 Ca -0.19 0.94 0.00 0.00 -0.00 0.00 0.00 56.01 56.76 1wuz n LEU 69 Cb 1.07 -0.44 0.00 0.00 -0.00 0.00 0.00 43.42 44.05 1wuz n LEU 69 CO 0.54 -0.44 0.00 0.00 -0.00 0.00 0.00 177.39 177.49 1wuz n GLY 71 N -0.91 1.09 2.57 0.00 0.00 0.15 -4.72 105.19 103.38 1wuz n GLY 71 Ca 0.00 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.09 1wuz n GLY 71 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1wuz n ARG 72 N 0.00 2.90 -3.22 1.61 3.00 -1.26 -4.68 116.66 115.01 1wuz n ARG 72 Ca 0.00 -2.12 -0.02 0.00 -0.00 0.00 0.00 57.85 55.71 1wuz n ARG 72 Cb 0.00 -2.87 -0.03 0.00 0.00 0.00 0.00 32.46 29.56 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 3.02 -0.69 0.55 6.15 0.15 -1.26 -5.01 113.70 116.61 1wuz s SER 73 Ca 0.56 0.08 0.29 0.00 0.70 0.00 0.00 55.95 57.57 1wuz s SER 73 Cb 0.15 1.63 1.46 0.00 -1.71 0.00 0.00 66.02 67.55 1wuz s SER 73 CO -0.04 -0.31 1.94 0.00 1.20 0.00 0.00 173.24 176.02 1wuz h ALA 74 N 8.08 2.50 -1.95 5.45 0.00 -1.91 -3.38 119.26 128.05 1wuz h ALA 74 Ca -0.08 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.67 1wuz h ALA 74 Cb 1.16 0.05 -0.29 0.00 0.00 0.00 0.00 17.79 18.70 1wuz h ALA 74 CO 0.22 -0.81 -0.45 -1.83 0.00 0.00 0.00 179.25 176.38 1wuz s GLU 75 N -4.87 0.35 -0.13 0.00 -1.05 -1.26 -4.55 118.70 107.19 1wuz s GLU 75 Ca -0.05 0.63 -0.01 0.00 -0.15 0.00 0.00 54.97 55.39 1wuz s GLU 75 Cb 0.19 -0.31 -0.02 0.00 -0.44 0.00 0.00 34.13 33.55 1wuz s GLU 75 CO 0.69 -0.58 -0.09 0.00 0.95 0.00 0.00 175.26 176.22 1wuz s SER 77 N 0.19 6.36 -0.01 0.00 1.04 -1.26 -2.55 113.70 117.46 1wuz s SER 77 Ca -0.05 0.30 0.04 0.00 0.48 0.00 0.00 55.95 56.71 1wuz s SER 77 Cb -0.15 -1.98 -0.01 0.00 0.10 0.00 0.00 66.02 63.99 1wuz s SER 77 CO 0.04 0.21 -0.12 -0.63 0.98 0.00 0.00 173.24 173.72 1wuz s ILE 78 N -1.43 0.92 -0.02 -1.02 1.09 -0.59 -5.02 121.20 115.13 1wuz s ILE 78 Ca 0.32 -0.49 0.05 0.00 -1.10 0.00 0.00 60.65 59.42 1wuz s ILE 78 Cb -0.13 -0.77 -0.03 0.00 -1.06 0.00 0.00 42.46 40.47 1wuz s ILE 78 CO 0.24 0.26 -0.15 -1.00 -0.10 0.00 0.00 174.94 174.19 1wuz s HIS 79 N -0.23 2.66 0.04 3.97 3.76 -1.26 -1.89 115.29 122.34 1wuz s HIS 79 Ca 0.04 -0.19 -0.06 0.00 -0.15 0.00 0.00 55.06 54.70 1wuz s HIS 79 Cb -0.05 -1.57 -0.01 0.00 1.11 0.00 0.00 32.58 32.05 1wuz s HIS 79 CO -0.00 0.21 0.10 -1.17 -0.85 0.00 0.00 174.74 173.03 1wuz s LEU 80 N -0.99 1.80 -0.11 0.89 0.20 0.70 -4.52 118.68 116.64 1wuz s LEU 80 Ca 0.13 -0.57 -0.00 0.00 0.69 0.00 0.00 54.13 54.38 1wuz s LEU 80 Cb -0.11 0.63 0.02 0.00 -0.43 0.00 0.00 46.19 46.31 1wuz s LEU 80 CO 0.02 -0.54 -0.09 -1.61 -0.29 0.00 0.00 176.35 173.85 1wuz s GLU 81 N -2.81 1.67 -0.47 1.98 8.01 -0.34 -2.14 118.70 124.61 1wuz s GLU 81 Ca -0.03 -0.32 -0.21 0.00 0.01 0.00 0.00 54.97 54.42 1wuz s GLU 81 Cb 0.00 -1.66 0.03 0.00 -4.31 0.00 0.00 34.13 28.20 1wuz s GLU 81 CO -0.05 -0.23 0.70 0.08 0.01 0.00 0.00 175.26 175.76 1wuz s VAL 82 N 1.57 4.75 -0.40 2.63 1.01 -1.08 -1.98 120.40 126.91 1wuz s VAL 82 Ca 0.03 0.03 -0.28 0.00 0.00 0.00 0.00 61.98 61.76 1wuz s VAL 82 Cb -0.13 -4.29 0.02 0.00 0.00 0.00 0.00 36.38 31.98 1wuz s VAL 82 CO -0.07 -0.74 1.04 -0.63 0.00 0.00 0.00 175.10 174.70 1wuz s ILE 83 N 2.99 4.43 -0.11 2.22 1.09 -0.09 -2.30 121.20 129.43 1wuz s ILE 83 Ca 0.23 1.34 0.04 0.00 -1.10 0.00 0.00 60.65 61.15 1wuz s ILE 83 Cb -0.15 -4.46 0.00 0.00 -1.06 0.00 0.00 42.46 36.80 1wuz s ILE 83 CO 0.18 -0.70 -0.23 0.68 -0.10 0.00 0.00 174.94 174.77 1wuz s VAL 84 N 3.87 2.01 -0.29 2.92 -7.23 -1.00 -0.41 120.40 120.26 1wuz s VAL 84 Ca 0.43 -0.98 -0.10 0.00 -1.81 0.00 0.00 61.98 59.53 1wuz s VAL 84 Cb -0.10 -1.75 -0.03 0.00 0.56 0.00 0.00 36.38 35.06 1wuz s VAL 84 CO 0.22 0.55 0.16 -0.62 -0.31 0.00 0.00 175.10 175.10 1wuz s ASP 85 N 0.48 5.70 -0.20 4.85 -1.08 -0.69 -2.57 116.67 123.18 1wuz s ASP 85 Ca -0.16 -0.28 -0.04 0.00 -0.52 0.00 0.00 52.55 51.56 1wuz s ASP 85 Cb -0.17 -2.05 0.00 0.00 -1.46 0.00 0.00 42.92 39.25 1wuz s ASP 85 CO 0.06 -0.12 0.15 -1.14 0.52 0.00 0.00 175.17 174.63 1wuz n ARG 86 N 5.02 -1.65 -1.36 4.34 0.63 -1.26 -3.80 116.66 118.58 1wuz n ARG 86 Ca -0.14 1.60 -0.31 0.00 -0.92 0.00 0.00 57.85 58.07 1wuz n ARG 86 Cb 0.51 -3.59 0.08 0.00 0.45 0.00 0.00 32.46 29.91 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 -1.34 2.36 -0.56 -0.14 0.04 -1.26 -4.64 135.00 129.46 1wuz s PRO 87 Ca 0.06 1.21 -0.22 0.00 0.04 0.00 0.00 61.00 62.10 1wuz s PRO 87 Cb -0.02 -1.91 0.06 0.00 0.04 0.00 0.00 34.50 32.67 1wuz s PRO 87 CO 0.43 -1.57 0.82 -0.51 0.04 0.00 0.00 177.00 176.21 1wuz s LEU 88 N -5.71 4.55 0.00 -3.56 1.02 -1.26 -4.71 118.68 109.01 1wuz s LEU 88 Ca 0.62 -0.75 -0.17 0.00 0.02 0.00 0.00 54.13 53.86 1wuz s LEU 88 Cb -0.18 -2.58 0.06 0.00 0.02 0.00 0.00 46.19 43.51 1wuz s LEU 88 CO 0.53 -1.15 0.78 0.00 0.02 0.00 0.00 176.35 176.53 1wuz n GLN 89 N 6.98 0.25 -4.25 1.70 1.13 -1.06 -5.06 117.38 117.07 1wuz n GLN 89 Ca -0.03 -0.71 -0.18 0.00 -1.94 0.00 0.00 57.00 54.14 1wuz n GLN 89 Cb 0.46 1.05 -0.11 0.00 0.11 0.00 0.00 30.24 31.75 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 -2.14 1.36 -0.17 5.09 1.01 -1.26 -2.37 120.40 121.93 1wuz s VAL 90 Ca 0.18 -1.79 -0.02 0.00 0.00 0.00 0.00 61.98 60.36 1wuz s VAL 90 Cb -0.01 -1.60 -0.01 0.00 0.00 0.00 0.00 36.38 34.75 1wuz s VAL 90 CO 0.01 -0.45 -0.09 -0.36 0.00 0.00 0.00 175.10 174.21 1wuz s PHE 91 N -2.28 2.89 -0.20 5.22 0.08 -0.97 -4.91 117.98 117.80 1wuz s PHE 91 Ca 0.11 -0.79 -0.29 0.00 0.12 0.00 0.00 56.93 56.08 1wuz s PHE 91 Cb -0.04 -1.96 -0.03 0.00 -0.57 0.00 0.00 43.02 40.42 1wuz s PHE 91 CO 0.03 -0.36 1.60 -1.58 -0.10 0.00 0.00 175.22 174.81 1wuz s HIS 92 N 0.85 2.13 -0.10 0.36 2.46 -0.62 -2.63 115.29 117.73 1wuz s HIS 92 Ca -0.03 0.53 0.03 0.00 0.47 0.00 0.00 55.06 56.06 1wuz s HIS 92 Cb -0.15 -3.95 0.01 0.00 -0.13 0.00 0.00 32.58 28.36 1wuz s HIS 92 CO 0.01 -2.99 -0.20 0.08 -2.47 0.00 0.00 174.74 169.17 1wuz s VAL 93 N 4.98 1.81 -0.16 0.89 1.01 -0.91 -0.91 120.40 127.11 1wuz s VAL 93 Ca 0.71 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 1wuz s VAL 93 Cb -0.26 -1.59 0.05 0.00 0.00 0.00 0.00 36.38 34.58 1wuz s VAL 93 CO 0.28 0.50 0.04 -0.70 0.00 0.00 0.00 175.10 175.23 1wuz s GLU 94 N 0.60 0.49 -0.15 2.72 2.12 -0.26 -0.21 118.70 124.00 1wuz s GLU 94 Ca -0.14 -0.20 -0.03 0.00 0.36 0.00 0.00 54.97 54.96 1wuz s GLU 94 Cb -0.17 -1.75 -0.03 0.00 0.26 0.00 0.00 34.13 32.45 1wuz s GLU 94 CO 0.04 -0.56 -0.05 0.14 -0.54 0.00 0.00 175.26 174.29 1wuz s VAL 95 N 1.96 3.80 0.11 3.70 -7.23 -0.79 -0.46 120.40 121.48 1wuz s VAL 95 Ca 0.01 -0.40 0.05 0.00 -1.81 0.00 0.00 61.98 59.84 1wuz s VAL 95 Cb -0.16 -2.65 -0.04 0.00 0.56 0.00 0.00 36.38 34.09 1wuz s VAL 95 CO -0.07 0.50 0.01 -0.70 -0.31 0.00 0.00 175.10 174.53 1wuz s GLU 96 N 0.30 2.53 -0.21 4.82 2.12 -1.10 -1.54 118.70 125.62 1wuz s GLU 96 Ca -0.04 -0.89 -0.12 0.00 0.36 0.00 0.00 54.97 54.28 1wuz s GLU 96 Cb -0.14 -2.51 -0.05 0.00 0.26 0.00 0.00 34.13 31.69 1wuz s GLU 96 CO 0.03 0.52 0.22 0.14 -0.54 0.00 0.00 175.26 175.63 1wuz s VAL 97 N -1.41 5.33 -0.32 3.70 -7.23 -1.06 -2.56 120.40 116.86 1wuz s VAL 97 Ca 0.26 0.34 -0.10 0.00 -1.81 0.00 0.00 61.98 60.67 1wuz s VAL 97 Cb -0.11 -3.56 -0.01 0.00 0.56 0.00 0.00 36.38 33.26 1wuz s VAL 97 CO 0.19 0.36 0.17 -0.60 -0.31 0.00 0.00 175.10 174.90 1wuz s ARG 98 N 0.85 3.33 0.00 4.82 3.52 -1.03 -4.39 118.95 126.06 1wuz s ARG 98 Ca 0.11 -0.73 0.00 0.00 -0.13 0.00 0.00 55.73 54.99 1wuz s ARG 98 Cb -0.13 -3.61 0.00 0.00 -1.56 0.00 0.00 34.95 29.65 1wuz s ARG 98 CO 0.04 -0.43 0.00 -3.47 -0.81 0.00 0.00 175.30 170.62 1wuz n ASP 99 N 5.00 0.00 -4.42 -2.12 2.03 -1.26 -2.22 116.55 113.56 1wuz n ASP 99 Ca -0.14 -0.96 -0.25 0.00 0.52 0.00 0.00 54.79 53.96 1wuz n ASP 99 Cb 0.49 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.78 1wuz n ASP 99 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1wuz s ILE 100 N -2.02 2.29 -0.05 5.18 -1.09 -1.26 -4.85 121.20 119.39 1wuz s ILE 100 Ca 0.00 -2.14 -0.23 0.00 -2.23 0.00 0.00 60.65 56.04 1wuz s ILE 100 Cb 0.00 -2.14 -0.26 0.00 -1.58 0.00 0.00 42.46 38.48 1wuz s ILE 100 CO 0.00 -0.26 0.97 -0.55 -1.23 0.00 0.00 174.94 173.87 1wuz h ASN 101 N 2.89 0.32 -0.87 3.58 7.08 -1.87 -3.29 115.58 123.43 1wuz h ASN 101 Ca -0.43 -0.86 -0.41 0.00 -3.08 0.00 0.00 56.30 51.52 1wuz h ASN 101 Cb 1.22 -0.10 -0.25 0.00 -2.08 0.00 0.00 38.32 37.12 1wuz h ASN 101 CO 0.53 1.15 0.52 0.47 -2.08 0.00 0.00 177.43 178.02 1wuz n ASP 102 N -4.35 3.92 0.00 6.14 8.00 -1.26 -4.97 116.55 124.03 1wuz n ASP 102 Ca -0.11 -3.39 0.00 0.00 0.71 0.00 0.00 54.79 52.00 1wuz n ASP 102 Cb 0.63 -0.79 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 1wuz n ASP 102 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40