#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 6.39 -0.12 1.61 -0.87 -1.26 -4.74 114.94 115.96 1wuz s ASN 2 Ca 0.00 -1.45 0.08 0.00 -1.57 0.00 0.00 52.86 49.91 1wuz s ASN 2 Cb 0.00 -2.43 -0.13 0.00 -0.02 0.00 0.00 41.25 38.67 1wuz s ASN 2 CO 0.00 -1.31 -0.00 -1.54 -2.57 0.00 0.00 177.10 171.68 1wuz n SER 3 N 7.41 2.43 -4.39 -1.22 3.41 -1.26 -4.89 113.62 115.11 1wuz n SER 3 Ca 0.12 -0.02 -0.45 0.00 -0.26 0.00 0.00 58.87 58.26 1wuz n SER 3 Cb 0.48 0.51 -0.06 0.00 -0.26 0.00 0.00 64.21 64.87 1wuz n SER 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wuz s GLN 4 N -2.27 3.03 0.02 4.33 0.00 -1.26 -1.42 119.66 122.08 1wuz s GLN 4 Ca -0.09 -1.28 0.04 0.00 -0.00 0.00 0.00 55.36 54.03 1wuz s GLN 4 Cb 0.04 -4.17 -0.02 0.00 0.00 0.00 0.00 33.01 28.86 1wuz s GLN 4 CO 0.42 -1.20 -0.12 0.42 0.00 0.00 0.00 175.29 174.81 1wuz s ILE 5 N 2.05 0.92 0.02 3.63 -1.09 -0.39 -5.04 121.20 121.31 1wuz s ILE 5 Ca 0.08 -0.75 0.00 0.00 -2.23 0.00 0.00 60.65 57.75 1wuz s ILE 5 Cb -0.24 -0.82 -0.02 0.00 -1.58 0.00 0.00 42.46 39.80 1wuz s ILE 5 CO 0.07 0.07 -0.04 -1.38 -1.23 0.00 0.00 174.94 172.44 1wuz s HIS 6 N -0.62 0.34 0.37 3.97 -3.43 -1.26 -1.23 115.29 113.44 1wuz s HIS 6 Ca 0.02 -0.53 0.09 0.00 -0.80 0.00 0.00 55.06 53.83 1wuz s HIS 6 Cb -0.06 -0.23 -0.07 0.00 -1.43 0.00 0.00 32.58 30.78 1wuz s HIS 6 CO 0.00 -0.17 -0.05 0.71 -2.00 0.00 0.00 174.74 173.23 1wuz s TYR 7 N -1.46 2.45 -0.09 0.38 2.02 0.30 -4.87 117.35 116.08 1wuz s TYR 7 Ca -0.15 -0.57 0.02 0.00 -0.37 0.00 0.00 57.07 56.00 1wuz s TYR 7 Cb -0.10 -1.54 0.01 0.00 -0.40 0.00 0.00 41.96 39.93 1wuz s TYR 7 CO -0.01 0.53 -0.13 -1.12 -1.57 0.00 0.00 175.55 173.26 1wuz s SER 8 N -3.65 2.08 -0.09 2.29 0.01 -0.75 -2.70 113.70 110.88 1wuz s SER 8 Ca 0.33 -0.35 -0.04 0.00 1.31 0.00 0.00 55.95 57.21 1wuz s SER 8 Cb 0.05 -0.93 0.05 0.00 0.21 0.00 0.00 66.02 65.40 1wuz s SER 8 CO 0.17 0.01 0.21 -0.51 0.41 0.00 0.00 173.24 173.53 1wuz s ILE 9 N 0.91 -0.09 0.22 1.44 2.07 -1.07 -4.54 121.20 120.14 1wuz s ILE 9 Ca -0.09 0.18 -0.30 0.00 -1.41 0.00 0.00 60.65 59.03 1wuz s ILE 9 Cb -0.15 -0.34 -0.09 0.00 0.13 0.00 0.00 42.46 42.01 1wuz s ILE 9 CO 0.01 0.07 1.29 -2.16 -1.91 0.00 0.00 174.94 172.24 1wuz s PRO 10 N 1.39 4.41 0.88 3.50 0.04 -1.26 -2.42 135.00 141.54 1wuz s PRO 10 Ca -0.08 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 62.86 1wuz s PRO 10 Cb -0.11 -3.18 -0.03 0.00 0.04 0.00 0.00 34.50 31.22 1wuz s PRO 10 CO -0.08 -0.20 0.16 0.39 0.04 0.00 0.00 177.00 177.32 1wuz n GLU 11 N 2.23 -0.05 -3.24 4.56 1.02 -1.02 -3.09 120.64 121.05 1wuz n GLU 11 Ca 0.04 0.02 -0.19 0.00 -0.02 0.00 0.00 57.16 57.02 1wuz n GLU 11 Cb 0.43 -1.63 0.05 0.00 -0.02 0.00 0.00 31.44 30.27 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 -0.40 -5.73 -2.90 3.49 2.13 -1.24 -4.95 120.64 111.05 1wuz n GLU 12 Ca 0.06 0.68 -0.43 0.00 0.66 0.00 0.00 57.16 58.13 1wuz n GLU 12 Cb 0.53 -5.21 -0.04 0.00 0.27 0.00 0.00 31.44 26.99 1wuz n GLU 12 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wuz s ALA 13 N -3.20 3.16 0.70 4.31 0.00 -1.18 -4.91 121.76 120.65 1wuz s ALA 13 Ca 0.41 -1.84 -0.16 0.00 0.00 0.00 0.00 51.96 50.36 1wuz s ALA 13 Cb -0.18 -3.80 -0.04 0.00 0.00 0.00 0.00 23.12 19.11 1wuz s ALA 13 CO 0.51 -2.67 0.62 1.17 0.00 0.00 0.00 175.76 175.38 1wuz n LYS 14 N 7.48 0.37 -1.67 0.00 4.81 -1.26 -4.47 118.16 123.43 1wuz n LYS 14 Ca -0.04 0.17 -0.51 0.00 -0.87 0.00 0.00 58.31 57.06 1wuz n LYS 14 Cb 0.45 -1.89 -0.05 0.00 0.02 0.00 0.00 35.03 33.55 1wuz n LYS 14 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1wuz n HIS 15 N -2.32 2.07 0.00 5.64 8.25 -1.26 -1.76 115.22 125.83 1wuz n HIS 15 Ca 0.11 0.34 0.00 0.00 -0.26 0.00 0.00 57.72 57.90 1wuz n HIS 15 Cb 0.49 -2.51 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 3.69 1.00 3.77 -1.41 0.00 -0.84 -4.88 105.19 106.52 1wuz n GLY 16 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 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 4.58 0.34 2.61 2.01 -0.72 -4.63 115.64 117.83 1wuz s THR 17 Ca 0.00 1.56 -0.27 0.00 0.31 0.00 0.00 61.69 63.29 1wuz s THR 17 Cb 0.00 -4.07 -0.12 0.00 0.01 0.00 0.00 72.50 68.31 1wuz s THR 17 CO 0.00 0.47 1.16 0.33 -0.69 0.00 0.00 174.62 175.89 1wuz n PHE 18 N 2.06 1.78 0.01 4.92 -0.00 -1.26 -1.47 117.46 123.51 1wuz n PHE 18 Ca -0.06 0.60 0.00 0.00 -0.00 0.00 0.00 57.45 57.99 1wuz n PHE 18 Cb 0.50 -2.33 0.00 0.00 -0.00 0.00 0.00 39.48 37.64 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 0.12 0.28 -2.90 -2.13 0.31 -0.91 -4.77 118.33 108.34 1wuz n VAL 19 Ca 0.07 0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.49 1wuz n VAL 19 Cb 0.36 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 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 0.99 2.96 2.92 0.00 -1.26 -1.81 105.19 112.06 1wuz n GLY 20 Ca 0.00 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 1wuz n GLY 20 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1wuz s ARG 21 N 0.91 1.96 0.03 1.61 3.03 -1.26 -3.50 118.95 121.72 1wuz s ARG 21 Ca 0.00 -2.57 -0.18 0.00 2.03 0.00 0.00 55.73 55.01 1wuz s ARG 21 Cb 0.00 -3.32 -0.21 0.00 -1.03 0.00 0.00 34.95 30.39 1wuz s ARG 21 CO 0.00 -1.10 1.17 0.97 -1.13 0.00 0.00 175.30 175.21 1wuz h ILE 22 N 5.57 1.38 -0.00 4.99 2.10 -1.95 -2.66 117.51 126.94 1wuz h ILE 22 Ca -0.08 -1.99 -0.00 0.00 1.08 0.00 0.00 64.86 63.87 1wuz h ILE 22 Cb 0.90 2.40 -0.00 0.00 -1.09 0.00 0.00 36.82 39.03 1wuz h ILE 22 CO 0.68 0.59 -0.01 0.00 -1.08 0.00 0.00 178.15 178.33 1wuz h ALA 23 N 0.40 0.01 -0.34 0.18 0.00 -1.92 -2.30 119.26 115.28 1wuz h ALA 23 Ca -0.06 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.63 1wuz h ALA 23 Cb 1.28 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.01 1wuz h ALA 23 CO 0.12 -0.21 -0.03 0.37 0.00 0.00 0.00 179.25 179.50 1wuz h GLN 24 N -0.54 0.05 0.00 0.00 5.75 -1.85 0.24 115.11 118.77 1wuz h GLN 24 Ca 0.00 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1wuz h GLN 24 Cb 0.56 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.10 1wuz h GLN 24 CO 0.00 0.03 0.00 -0.25 -2.65 0.00 0.00 178.83 175.97 1wuz n ASP 25 N -5.22 0.04 0.04 -0.69 8.00 -1.00 -2.73 116.55 114.99 1wuz n ASP 25 Ca 0.01 0.51 -0.21 0.00 0.71 0.00 0.00 54.79 55.81 1wuz n ASP 25 Cb 0.18 -0.52 -0.14 0.00 -0.02 0.00 0.00 41.12 40.62 1wuz n ASP 25 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1wuz h LEU 26 N 0.00 0.48 0.00 0.64 4.07 -0.01 -3.44 115.31 117.05 1wuz h LEU 26 Ca 0.00 -0.89 0.00 0.00 0.08 0.00 0.00 57.88 57.07 1wuz h LEU 26 Cb 0.28 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 41.86 1wuz h LEU 26 CO 0.00 1.78 0.00 0.61 -1.08 0.00 0.00 178.44 179.75 1wuz n GLY 27 N 1.91 0.59 1.54 0.83 0.00 -0.11 -4.82 105.19 105.13 1wuz n GLY 27 Ca -0.28 -0.08 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 1wuz n GLY 27 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wuz n LEU 28 N 0.00 0.00 -4.61 0.99 4.77 -1.25 -5.05 117.00 111.84 1wuz n LEU 28 Ca 0.00 -0.71 -0.38 0.00 -0.03 0.00 0.00 56.01 54.88 1wuz n LEU 28 Cb 0.00 -0.33 -0.10 0.00 -2.33 0.00 0.00 43.42 40.66 1wuz n LEU 28 CO 0.00 -0.78 -0.08 -1.61 -1.33 0.00 0.00 177.39 173.58 1wuz s GLU 29 N -3.81 4.00 0.56 3.23 2.02 -1.26 -4.95 118.70 118.49 1wuz s GLU 29 Ca 0.28 -0.17 0.24 0.00 0.02 0.00 0.00 54.97 55.34 1wuz s GLU 29 Cb -0.01 -3.63 1.55 0.00 0.10 0.00 0.00 34.13 32.14 1wuz s GLU 29 CO 0.19 -0.17 2.19 1.25 0.02 0.00 0.00 175.26 178.74 1wuz h LEU 30 N 8.28 0.00 -1.66 1.80 7.12 -1.96 0.14 115.31 129.03 1wuz h LEU 30 Ca -0.34 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.67 1wuz h LEU 30 Cb 1.18 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.31 1wuz h LEU 30 CO 0.60 0.00 0.00 0.41 -0.13 0.00 0.00 178.44 179.32 1wuz n THR 31 N -4.17 0.22 0.11 1.05 -1.04 -1.26 -3.88 114.28 105.31 1wuz n THR 31 Ca -0.02 -0.49 0.03 0.00 -2.04 0.00 0.00 64.05 61.53 1wuz n THR 31 Cb 0.13 0.85 0.06 0.00 -1.82 0.00 0.00 70.33 69.54 1wuz n THR 31 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1wuz n GLU 32 N 0.91 1.26 -0.15 -2.82 4.07 0.44 -4.63 120.64 119.73 1wuz n GLU 32 Ca 0.17 -1.32 -0.10 0.00 -0.06 0.00 0.00 57.16 55.85 1wuz n GLU 32 Cb 0.48 -1.14 -0.01 0.00 -0.06 0.00 0.00 31.44 30.71 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 1.28 0.75 0.21 4.31 3.38 -1.53 -1.08 115.31 122.62 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 0.44 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1wuz h LEU 33 CO 0.00 0.89 -0.43 0.58 0.09 0.00 0.00 178.44 179.58 1wuz h VAL 34 N 0.59 0.14 0.00 1.22 2.07 -1.85 -1.50 116.25 116.92 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 0.52 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1wuz h VAL 34 CO 0.03 0.00 0.00 1.55 0.02 0.00 0.00 177.57 179.17 1wuz h PRO 35 N -0.72 0.00 -0.23 1.57 0.13 -1.87 -2.39 132.00 128.49 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 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 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 -2.46 1.67 -3.88 0.86 1.74 -0.41 -4.93 116.66 109.25 1wuz n ARG 36 Ca 0.02 -1.03 -0.32 0.00 -0.77 0.00 0.00 57.85 55.75 1wuz n ARG 36 Cb 0.24 -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 0.29 -2.10 -4.71 0.55 4.32 -0.90 -1.86 117.00 112.58 1wuz n LEU 37 Ca 0.13 -1.07 -0.42 0.00 -0.02 0.00 0.00 56.01 54.63 1wuz n LEU 37 Cb 0.27 -2.16 -0.03 0.00 -1.62 0.00 0.00 43.42 39.88 1wuz n LEU 37 CO 0.10 0.51 0.85 0.12 -1.22 0.00 0.00 177.39 177.75 1wuz s PHE 38 N -3.71 3.48 0.00 -1.77 5.36 -1.05 -2.62 117.98 117.68 1wuz s PHE 38 Ca 0.28 1.37 -0.14 0.00 -0.96 0.00 0.00 56.93 57.48 1wuz s PHE 38 Cb -0.11 -3.37 0.02 0.00 -0.34 0.00 0.00 43.02 39.22 1wuz s PHE 38 CO 0.90 -1.05 0.30 1.03 -1.46 0.00 0.00 175.22 174.94 1wuz s ARG 39 N 1.05 0.70 0.03 10.12 0.52 0.00 -5.01 118.95 126.36 1wuz s ARG 39 Ca 0.57 -0.29 0.03 0.00 -0.52 0.00 0.00 55.73 55.53 1wuz s ARG 39 Cb -0.28 0.31 -0.04 0.00 0.52 0.00 0.00 34.95 35.46 1wuz s ARG 39 CO 0.29 -0.20 -0.04 0.08 0.02 0.00 0.00 175.30 175.45 1wuz s VAL 40 N -1.66 3.84 -0.05 3.52 1.01 -1.26 -0.78 120.40 125.03 1wuz s VAL 40 Ca -0.11 -0.82 -0.11 0.00 0.00 0.00 0.00 61.98 60.93 1wuz s VAL 40 Cb -0.04 -2.73 0.02 0.00 0.00 0.00 0.00 36.38 33.63 1wuz s VAL 40 CO 0.02 0.30 0.26 0.00 0.00 0.00 0.00 175.10 175.69 1wuz s ALA 41 N -1.11 -0.66 0.06 5.51 0.00 -0.07 -4.84 121.76 120.64 1wuz s ALA 41 Ca 0.20 0.41 -0.05 0.00 0.00 0.00 0.00 51.96 52.52 1wuz s ALA 41 Cb -0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 1wuz s ALA 41 CO 0.11 -0.20 0.08 0.45 0.00 0.00 0.00 175.76 176.20 1wuz s SER 42 N -0.79 0.26 -0.05 0.00 0.15 -1.26 -0.44 113.70 111.58 1wuz s SER 42 Ca -0.09 -0.71 -0.07 0.00 0.70 0.00 0.00 55.95 55.78 1wuz s SER 42 Cb -0.05 0.25 -0.29 0.00 -1.71 0.00 0.00 66.02 64.22 1wuz s SER 42 CO 0.02 -0.60 0.65 0.50 1.20 0.00 0.00 173.24 175.02 1wuz h LYS 43 N 3.26 0.32 0.00 5.44 3.11 -1.95 -3.11 116.57 123.65 1wuz h LYS 43 Ca -0.33 -0.55 0.00 0.00 -2.81 0.00 0.00 60.65 56.95 1wuz h LYS 43 Cb 1.18 0.21 0.00 0.00 -1.00 0.00 0.00 32.23 32.61 1wuz h LYS 43 CO 0.57 1.22 0.00 -0.25 -2.81 0.00 0.00 179.45 178.18 1wuz n ASP 44 N -3.52 0.00 -0.00 4.20 9.92 -1.26 -4.54 116.55 121.36 1wuz n ASP 44 Ca -0.24 0.61 0.00 0.00 -0.53 0.00 0.00 54.79 54.63 1wuz n ASP 44 Cb 1.06 -0.11 -0.00 0.00 -0.64 0.00 0.00 41.12 41.44 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 -1.08 0.79 0.00 -1.24 0.63 -1.26 -5.01 116.66 109.50 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 -0.94 0.00 0.00 0.45 0.00 0.00 32.46 31.97 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 2.33 2.41 2.63 5.14 0.00 -1.18 -4.83 105.19 111.70 1wuz n GLY 46 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 2.08 0.03 1.61 2.03 -1.26 -3.98 116.55 117.06 1wuz n ASP 47 Ca 0.00 -2.83 -0.19 0.00 0.52 0.00 0.00 54.79 52.29 1wuz n ASP 47 Cb 0.00 -0.51 -0.13 0.00 -0.72 0.00 0.00 41.12 39.76 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 2.87 0.51 -8.17 -2.67 4.07 -1.91 -3.29 115.31 106.72 1wuz h LEU 48 Ca -0.03 -0.87 -0.12 0.00 0.08 0.00 0.00 57.88 56.95 1wuz h LEU 48 Cb 1.16 -0.16 -0.15 0.00 1.08 0.00 0.00 40.66 42.59 1wuz h LEU 48 CO 0.53 1.33 -0.58 -0.76 -1.08 0.00 0.00 178.44 177.87 1wuz s LEU 49 N -8.08 2.04 0.02 1.67 1.02 -1.26 -0.17 118.68 113.91 1wuz s LEU 49 Ca -0.13 -0.95 0.00 0.00 0.02 0.00 0.00 54.13 53.07 1wuz s LEU 49 Cb 0.02 0.46 -0.02 0.00 0.02 0.00 0.00 46.19 46.68 1wuz s LEU 49 CO 0.83 -0.67 -0.03 -0.70 0.02 0.00 0.00 176.35 175.81 1wuz s GLU 50 N -3.93 0.26 -0.04 1.70 2.12 -1.09 -4.84 118.70 112.87 1wuz s GLU 50 Ca 0.10 -0.49 -0.05 0.00 0.36 0.00 0.00 54.97 54.89 1wuz s GLU 50 Cb 0.07 0.06 -0.04 0.00 0.26 0.00 0.00 34.13 34.48 1wuz s GLU 50 CO -0.08 -0.03 0.19 0.54 -0.54 0.00 0.00 175.26 175.34 1wuz s VAL 51 N -1.14 5.43 -0.23 3.70 0.11 -1.26 -1.37 120.40 125.63 1wuz s VAL 51 Ca -0.12 0.03 -0.09 0.00 -2.93 0.00 0.00 61.98 58.87 1wuz s VAL 51 Cb -0.08 -3.50 -0.04 0.00 -1.53 0.00 0.00 36.38 31.22 1wuz s VAL 51 CO -0.01 0.43 0.12 0.21 -3.33 0.00 0.00 175.10 172.52 1wuz s ASN 52 N -1.60 5.80 0.00 3.54 2.47 -0.22 -4.94 114.94 119.98 1wuz s ASN 52 Ca 0.23 0.03 0.17 0.00 0.42 0.00 0.00 52.86 53.72 1wuz s ASN 52 Cb -0.13 -2.04 0.82 0.00 -1.45 0.00 0.00 41.25 38.46 1wuz s ASN 52 CO 0.14 0.06 1.54 0.18 -3.72 0.00 0.00 177.10 175.29 1wuz n LEU 53 N 4.31 0.00 0.32 3.21 4.32 -1.26 -0.26 117.00 127.63 1wuz n LEU 53 Ca -0.15 0.38 -0.17 0.00 -0.02 0.00 0.00 56.01 56.05 1wuz n LEU 53 Cb 0.52 -0.38 -0.08 0.00 -1.62 0.00 0.00 43.42 41.85 1wuz n LEU 53 CO 0.34 -0.16 0.65 -0.61 -1.22 0.00 0.00 177.39 176.39 1wuz h GLN 54 N 0.00 -0.80 0.00 3.23 5.75 -1.91 -3.37 115.11 118.01 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 0.22 0.18 0.00 0.00 1.07 0.00 0.00 27.48 28.96 1wuz h GLN 54 CO 0.00 -0.54 0.00 0.09 -2.65 0.00 0.00 178.83 175.73 1wuz n ASN 55 N -5.47 0.61 0.00 -0.69 4.13 -1.22 -5.00 115.26 107.62 1wuz n ASN 55 Ca -0.12 -1.07 0.00 0.00 1.68 0.00 0.00 54.58 55.07 1wuz n ASN 55 Cb 0.36 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.60 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 -0.04 2.65 3.77 7.41 0.00 0.64 -4.89 105.19 114.73 1wuz n GLY 56 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.21 3.25 0.11 -0.61 -1.09 -1.23 -3.44 121.20 115.98 1wuz s ILE 57 Ca 0.00 1.10 0.04 0.00 -2.23 0.00 0.00 60.65 59.56 1wuz s ILE 57 Cb 0.00 -3.64 -0.04 0.00 -1.58 0.00 0.00 42.46 37.20 1wuz s ILE 57 CO 0.00 0.15 0.08 -1.48 -1.23 0.00 0.00 174.94 172.46 1wuz s LEU 58 N -2.20 3.74 0.37 2.97 2.34 -1.23 -1.06 118.68 123.61 1wuz s LEU 58 Ca 0.53 -0.08 0.04 0.00 0.06 0.00 0.00 54.13 54.68 1wuz s LEU 58 Cb -0.31 -2.41 -0.04 0.00 -0.56 0.00 0.00 46.19 42.87 1wuz s LEU 58 CO 0.39 0.14 0.09 0.72 -1.06 0.00 0.00 176.35 176.63 1wuz s PHE 59 N -1.49 1.87 0.44 3.48 -0.12 -0.47 -2.14 117.98 119.55 1wuz s PHE 59 Ca 0.29 -1.10 -0.25 0.00 -0.05 0.00 0.00 56.93 55.82 1wuz s PHE 59 Cb -0.11 -1.24 -0.08 0.00 -0.63 0.00 0.00 43.02 40.95 1wuz s PHE 59 CO 0.22 -0.11 1.34 0.08 -0.05 0.00 0.00 175.22 176.69 1wuz s VAL 60 N -3.25 2.42 0.00 -2.49 1.01 -0.54 -2.68 120.40 114.88 1wuz s VAL 60 Ca 0.29 0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.64 1wuz s VAL 60 Cb 0.06 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.23 1wuz s VAL 60 CO 0.14 0.04 0.00 -3.20 0.00 0.00 0.00 175.10 172.09 1wuz n ASN 61 N -0.15 3.51 -1.87 3.32 2.85 -0.77 -1.98 115.26 120.17 1wuz n ASN 61 Ca 0.05 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.52 1wuz n ASN 61 Cb 0.43 0.15 0.00 0.00 1.24 0.00 0.00 39.78 41.61 1wuz n ASN 61 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1wuz n SER 62 N -2.07 1.39 -4.73 1.20 3.41 0.76 -4.91 113.62 108.66 1wuz n SER 62 Ca 0.00 -0.93 -0.41 0.00 -0.26 0.00 0.00 58.87 57.26 1wuz n SER 62 Cb 0.40 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 1wuz n SER 62 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1wuz s ARG 63 N -1.76 4.48 -0.01 4.33 3.00 -1.26 -4.69 118.95 123.04 1wuz s ARG 63 Ca 0.00 1.82 0.13 0.00 0.00 0.00 0.00 55.73 57.68 1wuz s ARG 63 Cb 0.00 -3.28 -0.19 0.00 0.00 0.00 0.00 34.95 31.48 1wuz s ARG 63 CO 0.00 -0.13 0.33 -0.89 0.00 0.00 0.00 175.30 174.61 1wuz n ILE 64 N 3.04 0.00 -1.58 1.52 2.08 -1.26 -4.17 119.36 118.98 1wuz n ILE 64 Ca 0.06 -0.28 -0.45 0.00 0.56 0.00 0.00 62.75 62.65 1wuz n ILE 64 Cb 0.45 0.37 -0.02 0.00 -0.75 0.00 0.00 39.64 39.70 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 -1.81 1.18 -0.31 4.38 5.75 -1.26 -3.65 116.55 120.84 1wuz n ASP 65 Ca -0.01 1.18 0.24 0.00 -0.01 0.00 0.00 54.79 56.19 1wuz n ASP 65 Cb 0.31 -1.27 0.55 0.00 -1.03 0.00 0.00 41.12 39.67 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 1.96 0.31 -0.46 0.11 0.11 -1.95 0.53 114.38 115.00 1wuz h ARG 66 Ca -0.39 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.68 1wuz h ARG 66 Cb 1.34 -0.07 -0.02 0.00 1.11 0.00 0.00 29.97 32.33 1wuz h ARG 66 CO 0.60 0.21 0.30 0.93 0.10 0.00 0.00 179.97 182.11 1wuz h GLU 67 N 0.32 0.60 0.00 0.08 4.39 -1.87 0.37 114.58 118.47 1wuz h GLU 67 Ca 0.57 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 60.21 1wuz h GLU 67 Cb 1.59 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 30.10 1wuz h GLU 67 CO -0.23 0.40 -0.21 0.93 -1.16 0.00 0.00 179.01 178.73 1wuz h GLU 68 N 0.62 0.00 0.00 2.33 4.39 -1.08 -3.41 114.58 117.44 1wuz h GLU 68 Ca 0.17 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.87 1wuz h GLU 68 Cb -0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1wuz h GLU 68 CO -0.04 0.34 0.00 -0.11 -1.16 0.00 0.00 179.01 178.05 1wuz n LEU 69 N -4.68 0.00 0.07 1.33 -0.00 0.16 -4.89 117.00 108.99 1wuz n LEU 69 Ca -0.07 0.90 0.00 0.00 -0.00 0.00 0.00 56.01 56.84 1wuz n LEU 69 Cb 0.23 -0.40 0.00 0.00 -0.00 0.00 0.00 43.42 43.25 1wuz n LEU 69 CO 0.12 -0.40 0.00 0.00 -0.00 0.00 0.00 177.39 177.11 1wuz n GLY 71 N -1.44 0.65 0.00 0.00 0.00 0.12 -4.74 105.19 99.77 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 -0.87 0.00 -4.25 1.61 5.12 -1.26 -4.95 116.66 112.05 1wuz n ARG 72 Ca -0.06 0.41 -0.27 0.00 -1.93 0.00 0.00 57.85 56.00 1wuz n ARG 72 Cb 0.43 -0.98 -0.09 0.00 -1.16 0.00 0.00 32.46 30.67 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 -2.57 4.43 0.46 0.55 0.15 -1.26 -5.00 113.70 110.47 1wuz s SER 73 Ca 0.00 -0.49 0.23 0.00 0.70 0.00 0.00 55.95 56.39 1wuz s SER 73 Cb 0.00 -0.83 1.24 0.00 -1.71 0.00 0.00 66.02 64.72 1wuz s SER 73 CO 0.00 0.11 1.86 0.00 1.20 0.00 0.00 173.24 176.42 1wuz h ALA 74 N 2.99 2.45 -3.18 5.45 0.00 -1.87 -3.33 119.26 121.77 1wuz h ALA 74 Ca -0.47 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 53.75 1wuz h ALA 74 Cb 1.20 0.01 -0.31 0.00 0.00 0.00 0.00 17.79 18.69 1wuz h ALA 74 CO 0.55 -0.73 -0.59 -2.00 0.00 0.00 0.00 179.25 176.48 1wuz s GLU 75 N -5.26 2.41 -0.18 0.00 2.12 -1.26 -4.11 118.70 112.42 1wuz s GLU 75 Ca -0.07 -1.41 -0.03 0.00 0.36 0.00 0.00 54.97 53.82 1wuz s GLU 75 Cb 0.22 -3.47 -0.01 0.00 0.26 0.00 0.00 34.13 31.12 1wuz s GLU 75 CO 0.78 -0.81 -0.07 0.00 -0.54 0.00 0.00 175.26 174.62 1wuz s SER 77 N 0.86 6.43 0.01 0.00 1.04 -1.26 -2.32 113.70 118.46 1wuz s SER 77 Ca -0.02 0.44 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 0.24 -0.11 -0.63 0.98 0.00 0.00 173.24 173.74 1wuz s ILE 78 N -1.34 0.84 -0.02 -1.02 1.09 -0.53 -5.01 121.20 115.21 1wuz s ILE 78 Ca 0.28 -0.63 0.05 0.00 -1.10 0.00 0.00 60.65 59.25 1wuz s ILE 78 Cb -0.13 -0.74 -0.03 0.00 -1.06 0.00 0.00 42.46 40.51 1wuz s ILE 78 CO 0.18 0.11 -0.15 -1.00 -0.10 0.00 0.00 174.94 173.98 1wuz s HIS 79 N -0.49 2.67 0.04 3.97 3.76 -1.26 -1.92 115.29 122.06 1wuz s HIS 79 Ca 0.02 -0.18 -0.04 0.00 -0.15 0.00 0.00 55.06 54.70 1wuz s HIS 79 Cb -0.05 -1.58 -0.02 0.00 1.11 0.00 0.00 32.58 32.04 1wuz s HIS 79 CO 0.00 0.21 0.07 -1.17 -0.85 0.00 0.00 174.74 173.00 1wuz s LEU 80 N -0.97 1.95 -0.18 0.89 0.20 0.70 -4.60 118.68 116.67 1wuz s LEU 80 Ca 0.13 -0.64 -0.00 0.00 0.69 0.00 0.00 54.13 54.30 1wuz s LEU 80 Cb -0.11 0.52 0.04 0.00 -0.43 0.00 0.00 46.19 46.22 1wuz s LEU 80 CO 0.02 -0.53 -0.06 -1.83 -0.29 0.00 0.00 176.35 173.66 1wuz s GLU 81 N -2.92 1.58 -0.46 1.98 -1.05 0.42 -1.92 118.70 116.33 1wuz s GLU 81 Ca -0.02 -0.60 -0.21 0.00 -0.15 0.00 0.00 54.97 53.98 1wuz s GLU 81 Cb 0.01 -2.12 0.03 0.00 -0.44 0.00 0.00 34.13 31.61 1wuz s GLU 81 CO -0.06 -0.43 0.69 0.08 0.95 0.00 0.00 175.26 176.48 1wuz s VAL 82 N 1.57 4.77 0.06 1.83 1.01 -1.06 -0.90 120.40 127.68 1wuz s VAL 82 Ca 0.00 0.05 -0.24 0.00 0.00 0.00 0.00 61.98 61.79 1wuz s VAL 82 Cb -0.16 -4.27 -0.06 0.00 0.00 0.00 0.00 36.38 31.89 1wuz s VAL 82 CO -0.08 -0.71 0.73 -0.51 0.00 0.00 0.00 175.10 174.53 1wuz s ILE 83 N 2.96 4.68 -0.02 2.22 -1.16 0.04 -1.88 121.20 128.05 1wuz s ILE 83 Ca 0.23 1.56 -0.02 0.00 -0.51 0.00 0.00 60.65 61.92 1wuz s ILE 83 Cb -0.15 -4.08 0.00 0.00 0.61 0.00 0.00 42.46 38.85 1wuz s ILE 83 CO 0.18 0.42 0.04 0.68 -2.81 0.00 0.00 174.94 173.45 1wuz s VAL 84 N -0.37 -0.00 -0.26 4.00 -7.23 -0.96 -0.82 120.40 114.76 1wuz s VAL 84 Ca 0.36 0.00 -0.05 0.00 -1.81 0.00 0.00 61.98 60.49 1wuz s VAL 84 Cb -0.21 -0.07 0.01 0.00 0.56 0.00 0.00 36.38 36.67 1wuz s VAL 84 CO 0.23 0.00 0.01 -0.62 -0.31 0.00 0.00 175.10 174.41 1wuz s ASP 85 N 0.03 4.70 -0.24 4.85 -1.08 -0.78 -2.44 116.67 121.70 1wuz s ASP 85 Ca -0.00 -0.67 -0.08 0.00 -0.52 0.00 0.00 52.55 51.29 1wuz s ASP 85 Cb -0.00 -1.79 0.01 0.00 -1.46 0.00 0.00 42.92 39.68 1wuz s ASP 85 CO 0.00 -0.13 0.28 -1.14 0.52 0.00 0.00 175.17 174.71 1wuz n ARG 86 N 4.79 -1.59 -1.72 4.34 0.63 -1.26 -3.72 116.66 118.13 1wuz n ARG 86 Ca -0.16 1.57 -0.33 0.00 -0.92 0.00 0.00 57.85 58.01 1wuz n ARG 86 Cb 0.48 -3.95 0.05 0.00 0.45 0.00 0.00 32.46 29.49 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 -1.76 2.76 -0.41 -0.14 0.04 -1.26 -4.56 135.00 129.67 1wuz s PRO 87 Ca 0.12 1.37 -0.18 0.00 0.04 0.00 0.00 61.00 62.35 1wuz s PRO 87 Cb -0.03 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.58 1wuz s PRO 87 CO 0.47 -1.28 0.48 -1.17 0.04 0.00 0.00 177.00 175.54 1wuz s LEU 88 N -4.94 4.73 0.00 -3.56 2.96 -1.25 -4.66 118.68 111.96 1wuz s LEU 88 Ca 0.67 -0.54 -0.18 0.00 -0.22 0.00 0.00 54.13 53.85 1wuz s LEU 88 Cb -0.20 -2.46 0.06 0.00 0.50 0.00 0.00 46.19 44.08 1wuz s LEU 88 CO 0.43 -0.60 0.82 0.00 -1.32 0.00 0.00 176.35 175.68 1wuz n GLN 89 N 5.72 0.01 -4.31 1.98 10.64 -1.02 -5.03 117.38 125.37 1wuz n GLN 89 Ca -0.06 -0.31 -0.20 0.00 -1.83 0.00 0.00 57.00 54.60 1wuz n GLN 89 Cb 0.48 0.61 -0.11 0.00 -0.86 0.00 0.00 30.24 30.36 1wuz n GLN 89 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1wuz s VAL 90 N -2.01 1.64 -0.16 -0.39 1.01 -1.26 -2.26 120.40 116.98 1wuz s VAL 90 Ca 0.20 -1.92 0.01 0.00 0.00 0.00 0.00 61.98 60.27 1wuz s VAL 90 Cb -0.00 -1.79 0.01 0.00 0.00 0.00 0.00 36.38 34.60 1wuz s VAL 90 CO -0.02 -0.41 -0.19 -0.36 0.00 0.00 0.00 175.10 174.12 1wuz s PHE 91 N -2.28 2.74 -0.28 5.22 0.08 -0.79 -4.93 117.98 117.74 1wuz s PHE 91 Ca 0.15 -1.37 -0.29 0.00 0.12 0.00 0.00 56.93 55.54 1wuz s PHE 91 Cb -0.04 -1.88 -0.02 0.00 -0.57 0.00 0.00 43.02 40.51 1wuz s PHE 91 CO 0.05 -0.65 1.69 -1.58 -0.10 0.00 0.00 175.22 174.63 1wuz s HIS 92 N 1.01 1.98 -0.11 0.36 2.46 -0.51 -2.57 115.29 117.90 1wuz s HIS 92 Ca -0.02 0.58 0.02 0.00 0.47 0.00 0.00 55.06 56.10 1wuz s HIS 92 Cb -0.15 -4.08 -0.01 0.00 -0.13 0.00 0.00 32.58 28.21 1wuz s HIS 92 CO -0.05 -2.91 -0.16 0.08 -2.47 0.00 0.00 174.74 169.22 1wuz s VAL 93 N 5.99 2.76 -0.17 0.89 1.01 -0.81 -1.26 120.40 128.82 1wuz s VAL 93 Ca 0.75 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.93 1wuz s VAL 93 Cb -0.23 -2.12 0.05 0.00 0.00 0.00 0.00 36.38 34.08 1wuz s VAL 93 CO 0.32 0.54 0.01 -0.70 0.00 0.00 0.00 175.10 175.27 1wuz s GLU 94 N 0.21 0.82 -0.16 2.72 2.12 -0.36 -0.22 118.70 123.83 1wuz s GLU 94 Ca -0.10 -0.39 -0.03 0.00 0.36 0.00 0.00 54.97 54.81 1wuz s GLU 94 Cb -0.16 -1.95 -0.03 0.00 0.26 0.00 0.00 34.13 32.26 1wuz s GLU 94 CO 0.06 -0.56 -0.05 0.14 -0.54 0.00 0.00 175.26 174.32 1wuz s VAL 95 N 1.82 3.80 0.17 3.70 -7.23 -0.81 -0.54 120.40 121.31 1wuz s VAL 95 Ca -0.00 -0.39 0.07 0.00 -1.81 0.00 0.00 61.98 59.85 1wuz s VAL 95 Cb -0.16 -2.66 -0.04 0.00 0.56 0.00 0.00 36.38 34.07 1wuz s VAL 95 CO -0.07 0.49 0.00 -0.70 -0.31 0.00 0.00 175.10 174.51 1wuz s GLU 96 N 0.39 2.42 -0.19 4.82 2.12 -1.10 -1.46 118.70 125.71 1wuz s GLU 96 Ca -0.05 -1.10 -0.08 0.00 0.36 0.00 0.00 54.97 54.11 1wuz s GLU 96 Cb -0.14 -2.37 -0.04 0.00 0.26 0.00 0.00 34.13 31.84 1wuz s GLU 96 CO 0.03 0.46 0.08 0.14 -0.54 0.00 0.00 175.26 175.43 1wuz s VAL 97 N -1.72 4.89 -0.37 3.70 -7.23 -0.98 -2.61 120.40 116.08 1wuz s VAL 97 Ca 0.27 0.01 -0.16 0.00 -1.81 0.00 0.00 61.98 60.29 1wuz s VAL 97 Cb -0.09 -3.22 -0.00 0.00 0.56 0.00 0.00 36.38 33.63 1wuz s VAL 97 CO 0.19 0.44 0.38 -0.60 -0.31 0.00 0.00 175.10 175.20 1wuz s ARG 98 N 0.48 3.40 -0.02 4.82 3.52 -1.01 -4.26 118.95 125.88 1wuz s ARG 98 Ca 0.04 -0.55 -0.06 0.00 -0.13 0.00 0.00 55.73 55.03 1wuz s ARG 98 Cb -0.12 -3.86 0.02 0.00 -1.56 0.00 0.00 34.95 29.43 1wuz s ARG 98 CO 0.00 -0.63 0.28 -3.47 -0.81 0.00 0.00 175.30 170.68 1wuz n ASP 99 N 5.42 -0.21 -4.36 -2.12 2.03 -1.26 -2.43 116.55 113.63 1wuz n ASP 99 Ca -0.09 -1.01 -0.22 0.00 0.52 0.00 0.00 54.79 54.00 1wuz n ASP 99 Cb 0.49 0.31 -0.11 0.00 -0.72 0.00 0.00 41.12 41.09 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 -2.02 1.93 0.13 5.18 -4.36 -1.26 -4.65 121.20 116.15 1wuz s ILE 100 Ca 0.07 -2.06 0.19 0.00 -0.26 0.00 0.00 60.65 58.59 1wuz s ILE 100 Cb -0.00 -1.97 0.14 0.00 1.25 0.00 0.00 42.46 41.88 1wuz s ILE 100 CO -0.01 -0.37 1.71 -1.13 0.24 0.00 0.00 174.94 175.38 1wuz h ASN 101 N 2.97 0.00 -0.78 4.36 -1.24 -1.89 -2.95 115.58 116.04 1wuz h ASN 101 Ca -0.41 0.00 -0.39 0.00 0.71 0.00 0.00 56.30 56.20 1wuz h ASN 101 Cb 1.22 0.00 -0.23 0.00 0.73 0.00 0.00 38.32 40.03 1wuz h ASN 101 CO 0.54 0.37 0.50 -0.67 -1.29 0.00 0.00 177.43 176.88 1wuz n ASP 102 N -3.48 3.67 0.00 1.15 2.03 -1.26 -4.99 116.55 113.68 1wuz n ASP 102 Ca 0.00 -3.26 0.00 0.00 0.52 0.00 0.00 54.79 52.05 1wuz n ASP 102 Cb 0.52 -0.77 0.00 0.00 -0.72 0.00 0.00 41.12 40.16 1wuz n ASP 102 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08