#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 -7.41 -1.28 1.61 4.13 -1.26 -4.97 115.26 106.07 1wuz n ASN 2 Ca 0.00 0.89 0.03 0.00 1.68 0.00 0.00 54.58 57.18 1wuz n ASN 2 Cb 0.00 -3.98 0.02 0.00 -1.54 0.00 0.00 39.78 34.28 1wuz n ASN 2 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1wuz n SER 3 N 0.66 0.82 -4.47 6.41 7.64 -1.26 -5.04 113.62 118.38 1wuz n SER 3 Ca 0.01 -2.03 -0.43 0.00 1.01 0.00 0.00 58.87 57.43 1wuz n SER 3 Cb 0.26 -0.28 -0.04 0.00 -1.01 0.00 0.00 64.21 63.14 1wuz n SER 3 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1wuz s GLN 4 N -0.06 3.18 0.03 1.43 0.74 -1.26 -1.04 119.66 122.67 1wuz s GLN 4 Ca 0.27 -0.69 0.05 0.00 0.05 0.00 0.00 55.36 55.04 1wuz s GLN 4 Cb 0.31 -4.16 -0.02 0.00 1.10 0.00 0.00 33.01 30.24 1wuz s GLN 4 CO -0.13 -1.63 -0.14 0.42 -0.55 0.00 0.00 175.29 173.26 1wuz s ILE 5 N 3.79 1.08 0.02 -2.34 -1.09 -0.29 -5.04 121.20 117.33 1wuz s ILE 5 Ca 0.23 -0.89 0.00 0.00 -2.23 0.00 0.00 60.65 57.77 1wuz s ILE 5 Cb -0.16 -0.96 -0.02 0.00 -1.58 0.00 0.00 42.46 39.74 1wuz s ILE 5 CO 0.13 0.07 -0.04 -1.38 -1.23 0.00 0.00 174.94 172.49 1wuz s HIS 6 N -0.72 0.32 0.32 3.97 -3.43 -1.26 -1.11 115.29 113.39 1wuz s HIS 6 Ca 0.02 -0.52 0.08 0.00 -0.80 0.00 0.00 55.06 53.84 1wuz s HIS 6 Cb -0.07 -0.22 -0.06 0.00 -1.43 0.00 0.00 32.58 30.79 1wuz s HIS 6 CO 0.01 -0.17 -0.06 0.71 -2.00 0.00 0.00 174.74 173.23 1wuz s TYR 7 N -1.43 2.20 -0.17 0.38 2.02 -0.78 -4.93 117.35 114.64 1wuz s TYR 7 Ca -0.15 -0.64 0.01 0.00 -0.37 0.00 0.00 57.07 55.93 1wuz s TYR 7 Cb -0.10 -1.31 0.01 0.00 -0.40 0.00 0.00 41.96 40.17 1wuz s TYR 7 CO -0.01 0.40 -0.20 -1.54 -1.57 0.00 0.00 175.55 172.63 1wuz s SER 8 N -3.54 3.22 -0.05 2.29 1.04 -0.79 -2.77 113.70 113.09 1wuz s SER 8 Ca 0.32 -0.61 0.01 0.00 0.48 0.00 0.00 55.95 56.15 1wuz s SER 8 Cb 0.04 -1.49 0.02 0.00 0.10 0.00 0.00 66.02 64.70 1wuz s SER 8 CO 0.15 0.03 -0.05 -0.51 0.98 0.00 0.00 173.24 173.84 1wuz s ILE 9 N 1.11 0.62 0.17 -1.02 -1.16 -1.06 -4.48 121.20 115.37 1wuz s ILE 9 Ca 0.00 -0.15 -0.30 0.00 -0.51 0.00 0.00 60.65 59.69 1wuz s ILE 9 Cb -0.14 -0.64 -0.08 0.00 0.61 0.00 0.00 42.46 42.20 1wuz s ILE 9 CO -0.08 0.25 1.32 -2.16 -2.81 0.00 0.00 174.94 171.46 1wuz s PRO 10 N 1.05 4.38 0.77 3.50 0.04 -1.26 -2.23 135.00 141.24 1wuz s PRO 10 Ca -0.09 2.04 -0.16 0.00 0.04 0.00 0.00 61.00 62.83 1wuz s PRO 10 Cb -0.14 -3.21 -0.06 0.00 0.04 0.00 0.00 34.50 31.13 1wuz s PRO 10 CO -0.01 -0.29 0.24 0.39 0.04 0.00 0.00 177.00 177.37 1wuz n GLU 11 N 2.99 0.13 -2.56 4.56 1.02 -1.05 -2.61 120.64 123.12 1wuz n GLU 11 Ca 0.07 0.08 -0.17 0.00 -0.02 0.00 0.00 57.16 57.12 1wuz n GLU 11 Cb 0.43 -1.61 0.01 0.00 -0.02 0.00 0.00 31.44 30.25 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 -0.12 -2.46 -2.62 3.49 2.13 -1.16 -4.92 120.64 114.98 1wuz n GLU 12 Ca 0.08 0.75 -0.43 0.00 0.66 0.00 0.00 57.16 58.21 1wuz n GLU 12 Cb 0.51 -5.16 -0.02 0.00 0.27 0.00 0.00 31.44 27.04 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 -2.91 3.40 0.69 4.31 0.00 -1.07 -4.81 121.76 121.36 1wuz s ALA 13 Ca 0.11 -0.16 -0.15 0.00 0.00 0.00 0.00 51.96 51.76 1wuz s ALA 13 Cb -0.05 -3.74 0.01 0.00 0.00 0.00 0.00 23.12 19.35 1wuz s ALA 13 CO 0.14 -1.71 1.13 0.21 0.00 0.00 0.00 175.76 175.53 1wuz s LYS 14 N 3.90 2.59 -0.20 0.00 2.20 -1.26 -4.49 119.74 122.48 1wuz s LYS 14 Ca 0.47 1.47 -0.37 0.00 -0.36 0.00 0.00 55.97 57.17 1wuz s LYS 14 Cb -0.11 -1.92 -0.13 0.00 -1.51 0.00 0.00 37.83 34.16 1wuz s LYS 14 CO 0.20 -1.43 1.85 0.72 -0.36 0.00 0.00 175.35 176.33 1wuz n HIS 15 N -2.57 2.16 0.00 4.03 8.25 -1.26 -1.33 115.22 124.49 1wuz n HIS 15 Ca 0.11 0.26 0.00 0.00 -0.26 0.00 0.00 57.72 57.83 1wuz n HIS 15 Cb 0.52 -2.56 0.00 0.00 1.12 0.00 0.00 29.99 29.06 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 4.48 1.08 3.77 -1.41 0.00 -0.94 -4.95 105.19 107.21 1wuz n GLY 16 Ca 0.26 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.90 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 4.14 0.29 2.61 2.01 -0.44 -4.69 115.64 117.55 1wuz s THR 17 Ca 0.00 1.90 -0.30 0.00 0.31 0.00 0.00 61.69 63.60 1wuz s THR 17 Cb 0.00 -4.11 -0.11 0.00 0.01 0.00 0.00 72.50 68.29 1wuz s THR 17 CO 0.00 0.27 1.47 0.12 -0.69 0.00 0.00 174.62 175.79 1wuz s PHE 18 N -1.46 2.88 0.00 4.92 5.36 -1.26 -1.31 117.98 127.11 1wuz s PHE 18 Ca 0.47 1.03 0.00 0.00 -0.96 0.00 0.00 56.93 57.47 1wuz s PHE 18 Cb -0.21 -3.90 0.00 0.00 -0.34 0.00 0.00 43.02 38.56 1wuz s PHE 18 CO 0.27 -2.87 0.00 0.28 -1.46 0.00 0.00 175.22 171.44 1wuz n VAL 19 N 1.79 0.00 0.00 3.12 0.31 -0.13 -4.74 118.33 118.68 1wuz n VAL 19 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1wuz n VAL 19 Cb 0.39 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 32.51 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 0.67 3.40 2.92 0.00 -1.24 -1.89 105.19 112.11 1wuz n GLY 20 Ca 0.00 -1.00 -0.44 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.47 3.45 -0.25 1.61 3.00 -1.26 -1.15 116.66 121.59 1wuz n ARG 21 Ca 0.00 -4.04 0.05 0.00 -0.01 0.00 0.00 57.85 53.85 1wuz n ARG 21 Cb 0.00 -2.88 0.18 0.00 0.00 0.00 0.00 32.46 29.76 1wuz n ARG 21 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.63 178.60 1wuz h ILE 22 N 4.29 0.60 0.13 0.55 2.10 -1.91 0.19 117.51 123.45 1wuz h ILE 22 Ca 0.28 -0.12 -0.01 0.00 1.08 0.00 0.00 64.86 66.09 1wuz h ILE 22 Cb 0.86 0.21 0.00 0.00 -1.09 0.00 0.00 36.82 36.80 1wuz h ILE 22 CO 1.19 0.07 -0.06 0.00 -1.08 0.00 0.00 178.15 178.27 1wuz h ALA 23 N 1.56 -0.17 -0.99 0.18 0.00 -1.89 -0.51 119.26 117.45 1wuz h ALA 23 Ca 0.41 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.27 1wuz h ALA 23 Cb 0.65 0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.41 1wuz h ALA 23 CO -0.44 -0.41 0.61 0.37 0.00 0.00 0.00 179.25 179.38 1wuz h GLN 24 N -0.55 0.88 0.00 0.00 4.15 -1.64 0.34 115.11 118.29 1wuz h GLN 24 Ca -0.02 -0.05 -0.09 0.00 0.77 0.00 0.00 58.65 59.26 1wuz h GLN 24 Cb 0.43 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 1wuz h GLN 24 CO 0.03 0.58 -0.43 -0.44 -1.93 0.00 0.00 178.83 176.64 1wuz h ASP 25 N 0.91 0.00 0.17 -0.69 3.32 -0.61 -3.23 116.42 116.30 1wuz h ASP 25 Ca 0.51 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 57.26 1wuz h ASP 25 Cb 0.59 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.17 1wuz h ASP 25 CO -0.30 0.43 -1.29 -0.07 -1.72 0.00 0.00 179.24 176.29 1wuz h LEU 26 N 0.00 0.86 -0.76 1.55 4.07 0.94 -3.49 115.31 118.47 1wuz h LEU 26 Ca -0.00 -0.82 0.00 0.00 0.08 0.00 0.00 57.88 57.14 1wuz h LEU 26 Cb 1.12 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.59 1wuz h LEU 26 CO 0.06 1.62 0.00 0.61 -1.08 0.00 0.00 178.44 179.65 1wuz n GLY 27 N 1.44 0.59 3.23 0.83 0.00 0.94 -5.08 105.19 107.13 1wuz n GLY 27 Ca -0.14 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.76 2.37 0.39 0.99 0.05 -1.23 -5.09 118.68 115.40 1wuz s LEU 28 Ca 0.00 -1.08 -0.24 0.00 0.05 0.00 0.00 54.13 52.86 1wuz s LEU 28 Cb 0.00 -0.16 -0.09 0.00 -2.05 0.00 0.00 46.19 43.88 1wuz s LEU 28 CO 0.00 -0.46 1.02 -0.70 -0.55 0.00 0.00 176.35 175.66 1wuz s GLU 29 N -3.84 4.24 0.38 1.48 2.12 -1.26 -4.77 118.70 117.06 1wuz s GLU 29 Ca 0.18 1.43 0.17 0.00 0.36 0.00 0.00 54.97 57.12 1wuz s GLU 29 Cb 0.05 -2.54 0.77 0.00 0.26 0.00 0.00 34.13 32.67 1wuz s GLU 29 CO 0.01 -0.06 1.79 1.25 -0.54 0.00 0.00 175.26 177.71 1wuz h LEU 30 N 2.53 0.00 -1.67 2.70 7.12 -1.97 -2.46 115.31 121.56 1wuz h LEU 30 Ca -0.48 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.53 1wuz h LEU 30 Cb 1.21 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.34 1wuz h LEU 30 CO 0.63 0.36 0.00 0.35 -0.13 0.00 0.00 178.44 179.65 1wuz n THR 31 N -3.73 0.24 0.66 1.05 -2.24 -1.26 -3.90 114.28 105.10 1wuz n THR 31 Ca -0.01 -0.50 0.09 0.00 -2.27 0.00 0.00 64.05 61.37 1wuz n THR 31 Cb 0.45 0.83 -0.12 0.00 -2.10 0.00 0.00 70.33 69.39 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 0.91 0.56 -0.12 -0.78 4.07 -0.94 -4.41 120.64 119.95 1wuz n GLU 32 Ca 0.17 -0.05 -0.11 0.00 -0.06 0.00 0.00 57.16 57.11 1wuz n GLU 32 Cb 0.48 -1.44 -0.03 0.00 -0.06 0.00 0.00 31.44 30.40 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 0.64 0.05 4.31 3.38 -1.65 -1.34 115.31 120.69 1wuz h LEU 33 Ca 0.00 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 57.65 1wuz h LEU 33 Cb 0.59 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 1wuz h LEU 33 CO 0.00 0.83 -0.46 0.58 0.09 0.00 0.00 178.44 179.48 1wuz h VAL 34 N 0.43 0.10 0.00 1.22 2.07 -1.81 -0.87 116.25 117.40 1wuz h VAL 34 Ca 0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1wuz h VAL 34 Cb 0.53 0.10 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 -0.64 0.00 -0.35 1.57 0.13 -1.80 -2.39 132.00 128.52 1wuz h PRO 35 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 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 -0.30 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.01 1wuz n ARG 36 N -2.47 1.87 -3.88 0.86 1.74 -0.39 -4.91 116.66 109.48 1wuz n ARG 36 Ca 0.02 -1.35 -0.31 0.00 -0.77 0.00 0.00 57.85 55.43 1wuz n ARG 36 Cb 0.24 -1.32 0.01 0.00 -1.02 0.00 0.00 32.46 30.38 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 0.59 -2.11 -4.73 0.55 7.99 -0.87 -1.75 117.00 116.68 1wuz n LEU 37 Ca 0.13 -1.07 -0.42 0.00 -0.01 0.00 0.00 56.01 54.65 1wuz n LEU 37 Cb 0.33 -2.17 -0.03 0.00 -0.11 0.00 0.00 43.42 41.44 1wuz n LEU 37 CO 0.09 0.51 0.93 0.12 -1.51 0.00 0.00 177.39 177.53 1wuz s PHE 38 N -3.72 3.38 -0.07 -1.77 5.36 -0.96 -2.46 117.98 117.74 1wuz s PHE 38 Ca 0.26 1.28 -0.15 0.00 -0.96 0.00 0.00 56.93 57.36 1wuz s PHE 38 Cb -0.11 -3.49 0.03 0.00 -0.34 0.00 0.00 43.02 39.11 1wuz s PHE 38 CO 0.90 -1.52 0.35 1.03 -1.46 0.00 0.00 175.22 174.52 1wuz s ARG 39 N 0.44 0.59 -0.03 10.12 0.52 0.04 -5.00 118.95 125.63 1wuz s ARG 39 Ca 0.57 0.13 -0.01 0.00 -0.52 0.00 0.00 55.73 55.90 1wuz s ARG 39 Cb -0.33 0.27 -0.04 0.00 0.52 0.00 0.00 34.95 35.38 1wuz s ARG 39 CO 0.33 -0.14 0.06 0.08 0.02 0.00 0.00 175.30 175.65 1wuz s VAL 40 N -0.68 4.62 0.38 3.52 1.01 -1.26 -0.75 120.40 127.24 1wuz s VAL 40 Ca -0.08 -0.36 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 1wuz s VAL 40 Cb -0.04 -3.07 0.05 0.00 0.00 0.00 0.00 36.38 33.32 1wuz s VAL 40 CO 0.03 0.42 0.76 0.00 0.00 0.00 0.00 175.10 176.32 1wuz s ALA 41 N -1.11 -0.67 0.09 5.51 0.00 -0.69 -4.86 121.76 120.04 1wuz s ALA 41 Ca 0.20 -0.78 -0.18 0.00 0.00 0.00 0.00 51.96 51.20 1wuz s ALA 41 Cb -0.12 0.72 0.04 0.00 0.00 0.00 0.00 23.12 23.76 1wuz s ALA 41 CO 0.10 -0.98 0.43 -1.54 0.00 0.00 0.00 175.76 173.78 1wuz s SER 42 N -3.07 -0.30 -0.05 0.00 1.04 -1.26 -1.53 113.70 108.54 1wuz s SER 42 Ca 0.16 -0.13 0.12 0.00 0.48 0.00 0.00 55.95 56.58 1wuz s SER 42 Cb -0.05 0.47 0.42 0.00 0.10 0.00 0.00 66.02 66.96 1wuz s SER 42 CO 0.12 -0.78 1.29 1.17 0.98 0.00 0.00 173.24 176.02 1wuz n LYS 43 N 0.09 2.45 0.00 4.02 4.81 -1.26 -3.93 118.16 124.34 1wuz n LYS 43 Ca -0.17 -1.67 0.00 0.00 -0.87 0.00 0.00 58.31 55.60 1wuz n LYS 43 Cb 0.62 -1.55 0.00 0.00 0.02 0.00 0.00 35.03 34.12 1wuz n LYS 43 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1wuz n ASP 44 N 0.64 0.00 -0.00 3.14 9.92 -1.26 -4.97 116.55 124.03 1wuz n ASP 44 Ca 0.15 0.00 0.01 0.00 -0.53 0.00 0.00 54.79 54.42 1wuz n ASP 44 Cb 0.52 -0.02 -0.01 0.00 -0.64 0.00 0.00 41.12 40.96 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 -1.57 1.46 -1.00 -1.24 0.63 -1.26 -5.00 116.66 108.67 1wuz n ARG 45 Ca 0.00 -0.01 -0.00 0.00 -0.92 0.00 0.00 57.85 56.92 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 2.13 0.23 2.49 5.14 0.00 -1.25 -4.86 105.19 109.07 1wuz n GLY 46 Ca -0.00 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.56 1.88 -0.10 1.61 2.03 -1.26 -4.55 116.55 115.60 1wuz n ASP 47 Ca -0.00 -3.04 -0.17 0.00 0.52 0.00 0.00 54.79 52.10 1wuz n ASP 47 Cb 0.29 -0.56 -0.08 0.00 -0.72 0.00 0.00 41.12 40.05 1wuz n ASP 47 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1wuz n LEU 48 N 0.01 2.34 -3.65 -2.67 4.32 -1.20 -4.32 117.00 111.82 1wuz n LEU 48 Ca 0.21 0.04 -0.13 0.00 -0.02 0.00 0.00 56.01 56.11 1wuz n LEU 48 Cb 0.69 -0.64 -0.06 0.00 -1.62 0.00 0.00 43.42 41.79 1wuz n LEU 48 CO 0.26 0.66 0.18 -0.76 -1.22 0.00 0.00 177.39 176.51 1wuz s LEU 49 N -6.53 0.29 0.01 2.23 1.02 -1.25 -1.30 118.68 113.15 1wuz s LEU 49 Ca -0.27 0.10 0.00 0.00 0.02 0.00 0.00 54.13 53.98 1wuz s LEU 49 Cb 0.08 1.81 -0.01 0.00 0.02 0.00 0.00 46.19 48.09 1wuz s LEU 49 CO 0.41 -0.64 -0.02 -1.61 0.02 0.00 0.00 176.35 174.51 1wuz s GLU 50 N -2.20 0.20 0.04 1.70 2.02 -1.08 -4.76 118.70 114.61 1wuz s GLU 50 Ca -0.07 -0.38 -0.10 0.00 0.02 0.00 0.00 54.97 54.45 1wuz s GLU 50 Cb -0.01 0.05 -0.05 0.00 0.10 0.00 0.00 34.13 34.22 1wuz s GLU 50 CO -0.00 -0.03 0.36 0.54 0.02 0.00 0.00 175.26 176.15 1wuz s VAL 51 N -0.89 5.15 -0.34 2.63 0.11 -1.26 -2.02 120.40 123.78 1wuz s VAL 51 Ca -0.10 0.45 -0.12 0.00 -2.93 0.00 0.00 61.98 59.28 1wuz s VAL 51 Cb -0.06 -3.63 -0.01 0.00 -1.53 0.00 0.00 36.38 31.15 1wuz s VAL 51 CO -0.01 0.37 0.21 0.21 -3.33 0.00 0.00 175.10 172.56 1wuz s ASN 52 N -1.59 5.87 0.40 3.54 2.47 0.53 -4.94 114.94 121.22 1wuz s ASN 52 Ca 0.29 -0.53 0.27 0.00 0.42 0.00 0.00 52.86 53.32 1wuz s ASN 52 Cb -0.14 -2.09 1.44 0.00 -1.45 0.00 0.00 41.25 39.01 1wuz s ASN 52 CO 0.16 -0.24 1.83 -0.07 -3.72 0.00 0.00 177.10 175.06 1wuz h LEU 53 N 8.45 0.00 -0.45 3.21 3.38 -1.95 0.32 115.31 128.26 1wuz h LEU 53 Ca -0.31 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.75 1wuz h LEU 53 Cb 1.15 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.82 1wuz h LEU 53 CO 0.64 0.00 -0.08 -0.61 0.09 0.00 0.00 178.44 178.48 1wuz h GLN 54 N 0.00 0.03 0.00 1.13 4.15 -1.94 -3.31 115.11 115.17 1wuz h GLN 54 Ca 0.00 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.37 1wuz h GLN 54 Cb 0.05 -0.01 -0.10 0.00 0.21 0.00 0.00 27.48 27.63 1wuz h GLN 54 CO 0.00 0.02 -0.57 -1.71 -1.93 0.00 0.00 178.83 174.64 1wuz n ASN 55 N -5.30 0.20 -2.86 -0.69 5.15 -1.06 -4.99 115.26 105.71 1wuz n ASN 55 Ca 0.04 -1.89 -0.20 0.00 -0.60 0.00 0.00 54.58 51.93 1wuz n ASN 55 Cb 0.24 -0.18 0.01 0.00 -0.53 0.00 0.00 39.78 39.32 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 0.13 -0.51 3.90 8.20 0.00 0.11 -4.96 105.19 112.05 1wuz n GLY 56 Ca 0.00 0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.99 5.26 -0.27 -0.61 1.10 -1.09 -3.45 121.20 119.15 1wuz s ILE 57 Ca 0.20 -0.00 -0.13 0.00 -0.51 0.00 0.00 60.65 60.21 1wuz s ILE 57 Cb -0.10 -3.61 -0.04 0.00 0.15 0.00 0.00 42.46 38.86 1wuz s ILE 57 CO 0.25 0.18 0.29 -0.22 -2.11 0.00 0.00 174.94 173.34 1wuz s LEU 58 N -2.28 4.04 0.06 8.50 1.98 -0.30 -0.34 118.68 130.34 1wuz s LEU 58 Ca 0.35 0.18 0.06 0.00 -2.89 0.00 0.00 54.13 51.83 1wuz s LEU 58 Cb -0.13 -2.30 -0.04 0.00 0.66 0.00 0.00 46.19 44.39 1wuz s LEU 58 CO 0.22 -0.12 -0.13 0.72 -1.89 0.00 0.00 176.35 175.16 1wuz s PHE 59 N 1.87 2.70 0.52 5.38 -0.12 -0.86 -0.95 117.98 126.51 1wuz s PHE 59 Ca 0.12 -0.17 -0.22 0.00 -0.05 0.00 0.00 56.93 56.60 1wuz s PHE 59 Cb -0.16 -1.47 -0.06 0.00 -0.63 0.00 0.00 43.02 40.70 1wuz s PHE 59 CO 0.10 0.35 1.30 0.08 -0.05 0.00 0.00 175.22 177.01 1wuz s VAL 60 N -1.07 2.38 -0.38 -2.49 1.01 -0.43 -2.64 120.40 116.79 1wuz s VAL 60 Ca 0.18 0.29 0.12 0.00 0.00 0.00 0.00 61.98 62.57 1wuz s VAL 60 Cb -0.11 -3.15 0.39 0.00 0.00 0.00 0.00 36.38 33.51 1wuz s VAL 60 CO 0.09 -0.00 1.03 -3.20 0.00 0.00 0.00 175.10 173.02 1wuz n ASN 61 N -0.83 -0.29 -2.26 3.32 2.85 -0.42 -2.22 115.26 115.41 1wuz n ASN 61 Ca 0.09 -2.92 0.02 0.00 -0.11 0.00 0.00 54.58 51.66 1wuz n ASN 61 Cb 0.46 0.32 0.01 0.00 1.24 0.00 0.00 39.78 41.81 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 -0.03 -0.49 -4.58 1.20 7.64 -1.12 -3.26 113.62 112.98 1wuz n SER 62 Ca 0.09 -1.07 -0.42 0.00 1.01 0.00 0.00 58.87 58.48 1wuz n SER 62 Cb 0.76 0.75 -0.05 0.00 -1.01 0.00 0.00 64.21 64.66 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 -2.00 3.70 -0.02 1.43 3.00 -1.26 -4.74 118.95 119.06 1wuz s ARG 63 Ca 0.13 0.27 0.13 0.00 0.00 0.00 0.00 55.73 56.26 1wuz s ARG 63 Cb -0.00 -3.83 -0.20 0.00 0.00 0.00 0.00 34.95 30.92 1wuz s ARG 63 CO -0.01 -0.92 0.32 -0.89 0.00 0.00 0.00 175.30 173.81 1wuz n ILE 64 N 5.89 0.00 -1.55 1.52 2.08 -1.26 -4.03 119.36 122.01 1wuz n ILE 64 Ca 0.03 -0.29 -0.52 0.00 0.56 0.00 0.00 62.75 62.54 1wuz n ILE 64 Cb 0.48 0.30 -0.05 0.00 -0.75 0.00 0.00 39.64 39.62 1wuz n ILE 64 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 1wuz n ASP 65 N -1.88 0.98 0.15 4.38 5.75 -1.26 -2.99 116.55 121.68 1wuz n ASP 65 Ca -0.02 1.14 0.19 0.00 -0.01 0.00 0.00 54.79 56.09 1wuz n ASP 65 Cb 0.33 -1.13 0.72 0.00 -1.03 0.00 0.00 41.12 40.01 1wuz n ASP 65 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 1wuz h ARG 66 N 3.45 0.00 0.19 0.11 -0.00 -1.93 0.71 114.38 116.92 1wuz h ARG 66 Ca -0.45 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 59.52 1wuz h ARG 66 Cb 1.36 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.34 1wuz h ARG 66 CO 0.70 0.00 -0.09 0.93 -0.00 0.00 0.00 179.97 181.51 1wuz h GLU 67 N 0.00 -0.25 0.00 0.08 3.07 -1.86 0.26 114.58 115.89 1wuz h GLU 67 Ca 0.15 0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 59.01 1wuz h GLU 67 Cb 1.11 0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 29.07 1wuz h GLU 67 CO -0.00 0.15 -0.18 1.49 -1.40 0.00 0.00 179.01 179.07 1wuz h GLU 68 N -0.79 0.00 0.00 2.33 4.57 -1.53 -3.40 114.58 115.76 1wuz h GLU 68 Ca -0.03 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1wuz h GLU 68 Cb 0.52 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 1wuz h GLU 68 CO 0.04 0.50 0.00 -0.11 -1.18 0.00 0.00 179.01 178.26 1wuz n LEU 69 N -4.66 0.00 0.08 1.64 7.94 0.24 -4.90 117.00 117.34 1wuz n LEU 69 Ca -0.08 0.80 0.00 0.00 -1.11 0.00 0.00 56.01 55.62 1wuz n LEU 69 Cb 0.29 -0.30 0.00 0.00 0.53 0.00 0.00 43.42 43.94 1wuz n LEU 69 CO 0.16 -0.30 0.00 0.00 -1.11 0.00 0.00 177.39 176.14 1wuz n GLY 71 N -1.42 1.50 3.08 0.00 0.00 0.92 -4.62 105.19 104.66 1wuz n GLY 71 Ca 0.00 0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 1wuz n GLY 71 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1wuz n ARG 72 N 0.00 2.10 -3.66 1.61 0.00 -1.26 -4.79 116.66 110.66 1wuz n ARG 72 Ca 0.00 -2.29 -0.07 0.00 -0.00 0.00 0.00 57.85 55.49 1wuz n ARG 72 Cb 0.00 -3.18 -0.08 0.00 -0.00 0.00 0.00 32.46 29.20 1wuz n ARG 72 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1wuz s SER 73 N 4.53 -0.79 0.55 2.89 0.01 -1.26 -5.02 113.70 114.61 1wuz s SER 73 Ca 0.55 1.29 0.30 0.00 1.31 0.00 0.00 55.95 59.41 1wuz s SER 73 Cb 0.12 1.31 1.47 0.00 0.21 0.00 0.00 66.02 69.12 1wuz s SER 73 CO 0.05 -0.22 1.90 0.00 0.41 0.00 0.00 173.24 175.38 1wuz h ALA 74 N 7.25 2.70 -1.44 1.44 0.00 -2.02 -3.42 119.26 123.78 1wuz h ALA 74 Ca -0.29 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 54.71 1wuz h ALA 74 Cb 1.19 0.06 -0.28 0.00 0.00 0.00 0.00 17.79 18.76 1wuz h ALA 74 CO 0.19 -1.00 0.49 -2.00 0.00 0.00 0.00 179.25 176.93 1wuz s GLU 75 N -4.92 0.33 -0.18 0.00 2.12 -1.26 -5.06 118.70 109.73 1wuz s GLU 75 Ca -0.05 0.52 -0.03 0.00 0.36 0.00 0.00 54.97 55.77 1wuz s GLU 75 Cb 0.20 0.09 -0.02 0.00 0.26 0.00 0.00 34.13 34.67 1wuz s GLU 75 CO 0.73 -0.06 -0.06 0.00 -0.54 0.00 0.00 175.26 175.33 1wuz s SER 77 N 0.91 4.89 -0.00 0.00 0.01 -1.26 -2.59 113.70 115.66 1wuz s SER 77 Ca -0.01 -0.30 0.01 0.00 1.31 0.00 0.00 55.95 56.97 1wuz s SER 77 Cb -0.15 -1.10 -0.00 0.00 0.21 0.00 0.00 66.02 64.98 1wuz s SER 77 CO 0.01 0.12 -0.05 -0.63 0.41 0.00 0.00 173.24 173.10 1wuz s ILE 78 N -1.55 0.38 -0.02 1.44 1.09 -0.48 -5.01 121.20 117.05 1wuz s ILE 78 Ca 0.27 -0.20 0.05 0.00 -1.10 0.00 0.00 60.65 59.66 1wuz s ILE 78 Cb -0.10 -0.32 -0.03 0.00 -1.06 0.00 0.00 42.46 40.95 1wuz s ILE 78 CO 0.18 0.11 -0.16 -1.00 -0.10 0.00 0.00 174.94 173.98 1wuz s HIS 79 N -0.11 2.65 0.04 3.97 3.76 -1.26 -1.79 115.29 122.56 1wuz s HIS 79 Ca 0.02 -0.19 -0.05 0.00 -0.15 0.00 0.00 55.06 54.69 1wuz s HIS 79 Cb -0.02 -1.57 -0.02 0.00 1.11 0.00 0.00 32.58 32.08 1wuz s HIS 79 CO -0.00 0.20 0.08 -1.17 -0.85 0.00 0.00 174.74 173.00 1wuz s LEU 80 N -0.97 1.90 -0.17 0.89 0.20 0.69 -4.83 118.68 116.40 1wuz s LEU 80 Ca 0.13 -0.61 -0.00 0.00 0.69 0.00 0.00 54.13 54.33 1wuz s LEU 80 Cb -0.11 0.55 0.04 0.00 -0.43 0.00 0.00 46.19 46.25 1wuz s LEU 80 CO 0.02 -0.53 -0.07 -1.61 -0.29 0.00 0.00 176.35 173.88 1wuz s GLU 81 N -2.85 1.57 -0.47 1.98 2.02 -0.58 -1.90 118.70 118.47 1wuz s GLU 81 Ca -0.03 -0.54 -0.21 0.00 0.02 0.00 0.00 54.97 54.21 1wuz s GLU 81 Cb 0.00 -2.03 0.03 0.00 0.10 0.00 0.00 34.13 32.23 1wuz s GLU 81 CO -0.06 -0.41 0.69 0.08 0.02 0.00 0.00 175.26 175.59 1wuz s VAL 82 N 1.60 4.76 0.08 2.63 1.01 -1.07 -1.70 120.40 127.72 1wuz s VAL 82 Ca 0.01 0.03 -0.25 0.00 0.00 0.00 0.00 61.98 61.77 1wuz s VAL 82 Cb -0.15 -4.28 -0.06 0.00 0.00 0.00 0.00 36.38 31.88 1wuz s VAL 82 CO -0.08 -0.73 0.76 -0.51 0.00 0.00 0.00 175.10 174.55 1wuz s ILE 83 N 2.97 4.61 0.00 2.22 -1.16 0.07 -1.85 121.20 128.07 1wuz s ILE 83 Ca 0.23 1.64 0.00 0.00 -0.51 0.00 0.00 60.65 62.01 1wuz s ILE 83 Cb -0.15 -4.12 -0.00 0.00 0.61 0.00 0.00 42.46 38.80 1wuz s ILE 83 CO 0.18 0.42 -0.01 0.68 -2.81 0.00 0.00 174.94 173.40 1wuz s VAL 84 N -0.44 0.06 -0.26 4.00 -7.23 -0.91 -0.78 120.40 114.85 1wuz s VAL 84 Ca 0.37 -0.10 -0.03 0.00 -1.81 0.00 0.00 61.98 60.41 1wuz s VAL 84 Cb -0.21 -0.07 0.02 0.00 0.56 0.00 0.00 36.38 36.67 1wuz s VAL 84 CO 0.24 -0.03 -0.03 -0.62 -0.31 0.00 0.00 175.10 174.35 1wuz s ASP 85 N -0.14 4.50 -0.26 4.85 -1.08 -0.72 -2.47 116.67 121.36 1wuz s ASP 85 Ca -0.01 -0.81 -0.08 0.00 -0.52 0.00 0.00 52.55 51.14 1wuz s ASP 85 Cb -0.01 -1.72 0.01 0.00 -1.46 0.00 0.00 42.92 39.74 1wuz s ASP 85 CO -0.00 -0.14 0.29 0.54 0.52 0.00 0.00 175.17 176.39 1wuz n ARG 86 N 4.72 -1.72 -1.70 4.34 5.12 -1.26 -3.43 116.66 122.73 1wuz n ARG 86 Ca -0.16 1.66 -0.33 0.00 -1.93 0.00 0.00 57.85 57.09 1wuz n ARG 86 Cb 0.47 -4.12 0.05 0.00 -1.16 0.00 0.00 32.46 27.71 1wuz n ARG 86 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1wuz s PRO 87 N -1.80 2.74 -0.39 5.56 0.04 -1.26 -4.33 135.00 135.56 1wuz s PRO 87 Ca 0.12 1.36 -0.17 0.00 0.04 0.00 0.00 61.00 62.35 1wuz s PRO 87 Cb -0.03 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.57 1wuz s PRO 87 CO 0.50 -1.29 0.45 -1.17 0.04 0.00 0.00 177.00 175.53 1wuz s LEU 88 N -4.99 4.61 0.00 -3.56 2.96 -1.26 -4.66 118.68 111.79 1wuz s LEU 88 Ca 0.66 -0.39 -0.16 0.00 -0.22 0.00 0.00 54.13 54.02 1wuz s LEU 88 Cb -0.20 -2.45 0.05 0.00 0.50 0.00 0.00 46.19 44.09 1wuz s LEU 88 CO 0.43 -0.52 0.69 0.00 -1.32 0.00 0.00 176.35 175.64 1wuz n GLN 89 N 5.64 0.01 -4.26 1.98 1.13 -1.03 -5.03 117.38 115.81 1wuz n GLN 89 Ca -0.07 -0.26 -0.18 0.00 -1.94 0.00 0.00 57.00 54.56 1wuz n GLN 89 Cb 0.48 0.51 -0.11 0.00 0.11 0.00 0.00 30.24 31.24 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 1.37 -0.17 5.09 1.01 -1.26 -2.13 120.40 122.30 1wuz s VAL 90 Ca 0.17 -1.83 0.01 0.00 0.00 0.00 0.00 61.98 60.33 1wuz s VAL 90 Cb -0.00 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.75 1wuz s VAL 90 CO -0.01 -0.48 -0.17 -0.36 0.00 0.00 0.00 175.10 174.07 1wuz s PHE 91 N -2.39 2.78 -0.28 5.22 0.08 -0.77 -4.93 117.98 117.68 1wuz s PHE 91 Ca 0.12 -1.36 -0.29 0.00 0.12 0.00 0.00 56.93 55.52 1wuz s PHE 91 Cb -0.03 -1.91 -0.02 0.00 -0.57 0.00 0.00 43.02 40.48 1wuz s PHE 91 CO 0.03 -0.66 1.69 -1.58 -0.10 0.00 0.00 175.22 174.61 1wuz s HIS 92 N 1.10 1.98 -0.10 0.36 2.46 -0.21 -2.59 115.29 118.28 1wuz s HIS 92 Ca 0.00 0.57 0.02 0.00 0.47 0.00 0.00 55.06 56.13 1wuz s HIS 92 Cb -0.14 -4.08 -0.01 0.00 -0.13 0.00 0.00 32.58 28.22 1wuz s HIS 92 CO -0.06 -2.92 -0.18 0.08 -2.47 0.00 0.00 174.74 169.18 1wuz s VAL 93 N 5.97 2.61 -0.19 0.89 1.01 -0.80 -1.14 120.40 128.76 1wuz s VAL 93 Ca 0.75 -0.84 -0.04 0.00 0.00 0.00 0.00 61.98 61.86 1wuz s VAL 93 Cb -0.23 -2.04 0.06 0.00 0.00 0.00 0.00 36.38 34.17 1wuz s VAL 93 CO 0.32 0.55 0.06 -1.61 0.00 0.00 0.00 175.10 174.42 1wuz s GLU 94 N 0.15 0.41 -0.15 2.72 2.02 -0.27 -0.22 118.70 123.35 1wuz s GLU 94 Ca -0.10 -0.29 -0.05 0.00 0.02 0.00 0.00 54.97 54.56 1wuz s GLU 94 Cb -0.16 -1.99 -0.03 0.00 0.10 0.00 0.00 34.13 32.05 1wuz s GLU 94 CO 0.06 -0.66 0.01 0.14 0.02 0.00 0.00 175.26 174.83 1wuz s VAL 95 N 1.97 4.33 0.18 2.63 -7.23 -0.74 -1.86 120.40 119.69 1wuz s VAL 95 Ca 0.00 -0.21 0.09 0.00 -1.81 0.00 0.00 61.98 60.05 1wuz s VAL 95 Cb -0.17 -2.90 -0.04 0.00 0.56 0.00 0.00 36.38 33.83 1wuz s VAL 95 CO -0.09 0.51 -0.07 -1.61 -0.31 0.00 0.00 175.10 173.53 1wuz s GLU 96 N 0.08 2.15 -0.04 4.82 2.02 -1.12 -1.38 118.70 125.24 1wuz s GLU 96 Ca 0.02 -1.24 -0.13 0.00 0.02 0.00 0.00 54.97 53.64 1wuz s GLU 96 Cb -0.13 -2.20 -0.05 0.00 0.10 0.00 0.00 34.13 31.84 1wuz s GLU 96 CO 0.02 0.43 0.36 0.14 0.02 0.00 0.00 175.26 176.23 1wuz s VAL 97 N -1.75 5.14 -0.22 2.63 -7.23 -1.07 -2.56 120.40 115.33 1wuz s VAL 97 Ca 0.26 0.72 -0.02 0.00 -1.81 0.00 0.00 61.98 61.12 1wuz s VAL 97 Cb -0.09 -3.66 0.01 0.00 0.56 0.00 0.00 36.38 33.21 1wuz s VAL 97 CO 0.16 0.57 -0.08 -0.60 -0.31 0.00 0.00 175.10 174.84 1wuz s ARG 98 N -0.91 3.12 -0.04 4.82 3.00 -0.95 -4.67 118.95 123.32 1wuz s ARG 98 Ca 0.22 -0.78 -0.17 0.00 -1.00 0.00 0.00 55.73 54.00 1wuz s ARG 98 Cb -0.16 -2.91 0.05 0.00 0.00 0.00 0.00 34.95 31.94 1wuz s ARG 98 CO 0.11 -0.27 0.74 -0.25 0.00 0.00 0.00 175.30 175.64 1wuz n ASP 99 N 4.72 -0.58 -4.32 -2.12 9.92 -1.26 -2.54 116.55 120.37 1wuz n ASP 99 Ca -0.18 -1.03 -0.20 0.00 -0.53 0.00 0.00 54.79 52.84 1wuz n ASP 99 Cb 0.49 0.87 -0.11 0.00 -0.64 0.00 0.00 41.12 41.74 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 -2.02 1.70 0.07 0.53 1.09 -1.26 -5.05 121.20 116.26 1wuz s ILE 100 Ca 0.18 -1.96 -0.13 0.00 -1.10 0.00 0.00 60.65 57.64 1wuz s ILE 100 Cb -0.00 -1.84 -0.25 0.00 -1.06 0.00 0.00 42.46 39.31 1wuz s ILE 100 CO -0.01 -0.41 1.17 -0.55 -0.10 0.00 0.00 174.94 175.03 1wuz h ASN 101 N 3.12 0.87 -0.31 3.58 -1.07 -1.92 -3.19 115.58 116.65 1wuz h ASN 101 Ca -0.41 -0.74 0.09 0.00 0.07 0.00 0.00 56.30 55.32 1wuz h ASN 101 Cb 1.21 -0.27 -0.01 0.00 -2.07 0.00 0.00 38.32 37.18 1wuz h ASN 101 CO 0.54 1.54 0.23 -0.78 0.07 0.00 0.00 177.43 179.02 1wuz h ASP 102 N 0.34 0.00 0.00 6.14 1.82 -1.99 -3.51 116.42 119.22 1wuz h ASP 102 Ca -0.15 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.49 1wuz h ASP 102 Cb 1.77 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.78 1wuz h ASP 102 CO 0.21 0.00 0.00 0.59 -1.61 0.00 0.00 179.24 178.43