#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 4.02 0.00 1.61 2.20 -1.26 -5.06 114.94 116.45 1wuz s ASN 2 Ca 0.00 -0.90 0.00 0.00 -0.94 0.00 0.00 52.86 51.02 1wuz s ASN 2 Cb 0.00 -0.53 0.00 0.00 -2.00 0.00 0.00 41.25 38.72 1wuz s ASN 2 CO 0.00 -0.03 0.00 -1.20 -2.94 0.00 0.00 177.10 172.93 1wuz n SER 3 N -0.78 1.48 -4.68 3.54 7.64 -1.26 -4.92 113.62 114.65 1wuz n SER 3 Ca -0.05 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.41 1wuz n SER 3 Cb 0.60 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.77 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 -1.97 4.34 0.04 1.43 0.00 -1.26 -0.55 119.66 121.69 1wuz s GLN 4 Ca 0.00 1.13 -0.02 0.00 -0.00 0.00 0.00 55.36 56.47 1wuz s GLN 4 Cb 0.00 -3.56 -0.02 0.00 0.00 0.00 0.00 33.01 29.42 1wuz s GLN 4 CO 0.00 -0.32 0.00 -1.50 0.00 0.00 0.00 175.29 173.47 1wuz s ILE 5 N 2.10 0.16 -0.01 3.63 1.10 0.69 -4.98 121.20 123.88 1wuz s ILE 5 Ca 0.41 -1.28 0.00 0.00 -0.51 0.00 0.00 60.65 59.27 1wuz s ILE 5 Cb -0.17 -0.88 0.01 0.00 0.15 0.00 0.00 42.46 41.57 1wuz s ILE 5 CO 0.14 -0.71 0.01 -1.00 -2.11 0.00 0.00 174.94 171.27 1wuz s HIS 6 N -2.64 0.02 0.42 3.50 3.76 -1.26 -0.37 115.29 118.72 1wuz s HIS 6 Ca -0.05 0.04 0.07 0.00 -0.15 0.00 0.00 55.06 54.98 1wuz s HIS 6 Cb -0.01 -0.09 -0.06 0.00 1.11 0.00 0.00 32.58 33.53 1wuz s HIS 6 CO -0.05 -0.03 0.14 0.71 -0.85 0.00 0.00 174.74 174.65 1wuz s TYR 7 N 0.38 2.56 -0.31 1.40 2.02 -0.84 -4.94 117.35 117.62 1wuz s TYR 7 Ca -0.03 -0.62 0.02 0.00 -0.37 0.00 0.00 57.07 56.07 1wuz s TYR 7 Cb -0.05 -1.91 0.09 0.00 -0.40 0.00 0.00 41.96 39.70 1wuz s TYR 7 CO -0.01 0.25 0.05 -1.54 -1.57 0.00 0.00 175.55 172.73 1wuz s SER 8 N -3.86 4.36 -0.13 2.29 1.04 -0.96 -2.70 113.70 113.75 1wuz s SER 8 Ca 0.39 -1.82 -0.01 0.00 0.48 0.00 0.00 55.95 54.98 1wuz s SER 8 Cb 0.05 -1.27 -0.02 0.00 0.10 0.00 0.00 66.02 64.88 1wuz s SER 8 CO 0.21 -0.37 -0.09 -0.51 0.98 0.00 0.00 173.24 173.46 1wuz s ILE 9 N 1.25 3.46 0.10 -1.02 2.07 -0.80 -4.64 121.20 121.63 1wuz s ILE 9 Ca 0.08 -0.52 -0.31 0.00 -1.41 0.00 0.00 60.65 58.49 1wuz s ILE 9 Cb -0.18 -2.48 -0.08 0.00 0.13 0.00 0.00 42.46 39.85 1wuz s ILE 9 CO -0.14 0.52 1.37 -2.16 -1.91 0.00 0.00 174.94 172.61 1wuz s PRO 10 N 0.22 4.33 0.40 3.50 0.04 -1.26 -1.15 135.00 141.08 1wuz s PRO 10 Ca -0.05 2.04 -0.24 0.00 0.04 0.00 0.00 61.00 62.78 1wuz s PRO 10 Cb -0.15 -3.27 -0.12 0.00 0.04 0.00 0.00 34.50 31.00 1wuz s PRO 10 CO 0.04 -0.42 0.76 -1.91 0.04 0.00 0.00 177.00 175.51 1wuz n GLU 11 N 4.00 0.89 -1.44 4.56 0.00 -1.00 -0.78 120.64 126.87 1wuz n GLU 11 Ca 0.11 0.32 -0.15 0.00 0.00 0.00 0.00 57.16 57.44 1wuz n GLU 11 Cb 0.43 -1.71 -0.06 0.00 0.00 0.00 0.00 31.44 30.09 1wuz n GLU 11 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1wuz n GLU 12 N 0.44 -1.14 -1.67 5.31 2.13 -1.13 -4.82 120.64 119.74 1wuz n GLU 12 Ca 0.11 1.02 -0.51 0.00 0.66 0.00 0.00 57.16 58.45 1wuz n GLU 12 Cb 0.38 -5.20 -0.05 0.00 0.27 0.00 0.00 31.44 26.83 1wuz n GLU 12 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wuz n ALA 13 N 1.28 0.63 -1.12 4.31 0.00 0.04 -4.67 120.51 120.98 1wuz n ALA 13 Ca -0.15 0.28 -0.33 0.00 0.00 0.00 0.00 53.44 53.24 1wuz n ALA 13 Cb 0.52 -2.44 0.12 0.00 0.00 0.00 0.00 19.45 17.65 1wuz n ALA 13 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1wuz s LYS 14 N 4.16 1.75 -0.10 0.00 -0.14 -1.26 -4.41 119.74 119.73 1wuz s LYS 14 Ca 0.96 1.64 -0.33 0.00 -1.36 0.00 0.00 55.97 56.88 1wuz s LYS 14 Cb -0.80 -1.80 -0.11 0.00 -1.68 0.00 0.00 37.83 33.45 1wuz s LYS 14 CO 0.55 -2.11 1.96 0.72 -0.76 0.00 0.00 175.35 175.71 1wuz n HIS 15 N -3.32 2.27 0.00 3.18 8.25 -1.26 -1.44 115.22 122.90 1wuz n HIS 15 Ca 0.13 -0.07 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1wuz n HIS 15 Cb 0.51 -2.69 0.00 0.00 1.12 0.00 0.00 29.99 28.93 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 4.74 1.06 3.77 -1.41 0.00 -0.88 -4.92 105.19 107.55 1wuz n GLY 16 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.89 1wuz n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wuz s THR 17 N -2.00 3.87 0.18 2.61 2.01 -0.52 -4.63 115.64 117.16 1wuz s THR 17 Ca 0.00 1.60 -0.30 0.00 0.31 0.00 0.00 61.69 63.30 1wuz s THR 17 Cb 0.00 -3.91 -0.08 0.00 0.01 0.00 0.00 72.50 68.52 1wuz s THR 17 CO 0.00 0.17 1.24 0.12 -0.69 0.00 0.00 174.62 175.47 1wuz s PHE 18 N -1.50 3.36 0.00 4.92 5.36 -1.26 -2.04 117.98 126.82 1wuz s PHE 18 Ca 0.51 1.32 -0.04 0.00 -0.96 0.00 0.00 56.93 57.77 1wuz s PHE 18 Cb -0.23 -3.50 -0.02 0.00 -0.34 0.00 0.00 43.02 38.93 1wuz s PHE 18 CO 0.29 -1.50 -0.08 0.28 -1.46 0.00 0.00 175.22 172.76 1wuz n VAL 19 N 2.70 0.98 0.00 3.12 0.31 -0.88 -4.71 118.33 119.85 1wuz n VAL 19 Ca 0.06 0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.59 1wuz n VAL 19 Cb 0.44 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.67 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 2.90 1.13 3.48 2.92 0.00 -1.26 -2.25 105.19 112.11 1wuz n GLY 20 Ca -0.06 0.48 -0.43 0.00 0.00 0.00 0.00 46.02 46.00 1wuz n GLY 20 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1wuz n ARG 21 N 0.00 0.52 -0.03 1.61 0.00 -1.26 -4.14 116.66 113.36 1wuz n ARG 21 Ca 0.00 0.06 -0.16 0.00 -0.00 0.00 0.00 57.85 57.75 1wuz n ARG 21 Cb 0.00 -2.25 -0.08 0.00 -0.00 0.00 0.00 32.46 30.12 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 7.65 1.36 0.23 8.89 2.10 -1.91 -2.37 117.51 133.46 1wuz h ILE 22 Ca -0.15 -1.85 -0.01 0.00 1.08 0.00 0.00 64.86 63.93 1wuz h ILE 22 Cb 1.31 2.19 0.00 0.00 -1.09 0.00 0.00 36.82 39.23 1wuz h ILE 22 CO 1.22 0.56 -0.11 0.00 -1.08 0.00 0.00 178.15 178.74 1wuz h ALA 23 N 0.48 -0.31 -0.95 0.18 0.00 -1.87 -0.52 119.26 116.27 1wuz h ALA 23 Ca -0.04 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.80 1wuz h ALA 23 Cb 1.18 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 19.01 1wuz h ALA 23 CO 0.11 -0.43 0.60 0.37 0.00 0.00 0.00 179.25 179.91 1wuz h GLN 24 N -0.80 0.83 0.00 0.00 5.75 -1.80 0.13 115.11 119.22 1wuz h GLN 24 Ca -0.03 -0.05 -0.15 0.00 -0.15 0.00 0.00 58.65 58.26 1wuz h GLN 24 Cb 0.51 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 28.85 1wuz h GLN 24 CO 0.05 0.55 -0.74 -0.44 -2.65 0.00 0.00 178.83 175.60 1wuz h ASP 25 N 0.85 0.00 -0.13 -0.69 5.19 -1.43 -3.22 116.42 117.00 1wuz h ASP 25 Ca 0.47 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.67 1wuz h ASP 25 Cb 0.60 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.11 1wuz h ASP 25 CO -0.24 0.74 -0.73 -0.07 -3.12 0.00 0.00 179.24 175.82 1wuz h LEU 26 N 0.00 0.90 -0.78 1.55 4.07 0.77 -3.45 115.31 118.36 1wuz h LEU 26 Ca -0.01 -0.56 0.00 0.00 0.08 0.00 0.00 57.88 57.39 1wuz h LEU 26 Cb 1.33 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.81 1wuz h LEU 26 CO 0.10 1.36 0.00 0.61 -1.08 0.00 0.00 178.44 179.42 1wuz n GLY 27 N 0.61 0.67 3.54 0.83 0.00 0.24 -4.11 105.19 106.97 1wuz n GLY 27 Ca -0.06 -0.27 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 1wuz n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wuz s LEU 28 N -0.78 2.11 -0.01 0.99 1.43 -1.23 -4.94 118.68 116.24 1wuz s LEU 28 Ca 0.00 -1.58 -0.24 0.00 -1.03 0.00 0.00 54.13 51.28 1wuz s LEU 28 Cb 0.00 -0.29 -0.05 0.00 0.03 0.00 0.00 46.19 45.88 1wuz s LEU 28 CO 0.00 -0.82 0.71 -0.70 0.23 0.00 0.00 176.35 175.77 1wuz s GLU 29 N -3.78 4.44 0.55 1.70 2.56 -1.26 -4.83 118.70 118.07 1wuz s GLU 29 Ca 0.25 0.93 0.22 0.00 0.00 0.00 0.00 54.97 56.37 1wuz s GLU 29 Cb 0.04 -3.40 1.47 0.00 2.00 0.00 0.00 34.13 34.25 1wuz s GLU 29 CO 0.13 0.20 2.16 1.25 -0.56 0.00 0.00 175.26 178.44 1wuz h LEU 30 N 6.15 0.00 -1.71 2.70 7.12 -1.96 0.14 115.31 127.75 1wuz h LEU 30 Ca -0.43 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.58 1wuz h LEU 30 Cb 1.20 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.33 1wuz h LEU 30 CO 0.73 0.00 0.00 0.41 -0.13 0.00 0.00 178.44 179.45 1wuz n THR 31 N -4.26 0.25 0.31 1.05 -1.04 -1.26 -3.94 114.28 105.39 1wuz n THR 31 Ca -0.01 -0.51 0.11 0.00 -2.04 0.00 0.00 64.05 61.59 1wuz n THR 31 Cb 0.17 0.84 -0.15 0.00 -1.82 0.00 0.00 70.33 69.37 1wuz n THR 31 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1wuz n GLU 32 N 0.95 0.45 -0.14 -2.82 -0.58 0.45 -4.37 120.64 114.58 1wuz n GLU 32 Ca 0.17 -0.13 -0.10 0.00 -0.42 0.00 0.00 57.16 56.68 1wuz n GLU 32 Cb 0.49 -1.52 -0.01 0.00 -0.57 0.00 0.00 31.44 29.83 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 0.71 0.17 -4.62 3.38 -1.62 -1.02 115.31 112.31 1wuz h LEU 33 Ca 0.00 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.67 1wuz h LEU 33 Cb 0.84 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 1wuz h LEU 33 CO 0.00 0.84 -0.44 0.58 0.09 0.00 0.00 178.44 179.51 1wuz h VAL 34 N 0.55 0.12 0.00 1.22 2.07 -1.80 -1.36 116.25 117.06 1wuz h VAL 34 Ca 0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1wuz h VAL 34 Cb 0.48 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1wuz h VAL 34 CO 0.02 0.00 0.00 1.55 0.02 0.00 0.00 177.57 179.16 1wuz h PRO 35 N -0.71 0.00 -0.32 1.57 0.13 -1.78 -2.43 132.00 128.46 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 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 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 -2.44 1.76 -3.89 0.86 1.74 -0.39 -4.90 116.66 109.40 1wuz n ARG 36 Ca 0.02 -1.19 -0.31 0.00 -0.77 0.00 0.00 57.85 55.60 1wuz n ARG 36 Cb 0.24 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 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 0.46 -2.12 -4.77 0.55 4.32 -0.91 -1.50 117.00 113.03 1wuz n LEU 37 Ca 0.11 -1.07 -0.41 0.00 -0.02 0.00 0.00 56.01 54.63 1wuz n LEU 37 Cb 0.28 -2.17 -0.01 0.00 -1.62 0.00 0.00 43.42 39.90 1wuz n LEU 37 CO 0.08 0.50 1.04 0.12 -1.22 0.00 0.00 177.39 177.91 1wuz s PHE 38 N -3.74 2.81 -0.02 -1.77 5.36 -1.00 -2.52 117.98 117.10 1wuz s PHE 38 Ca 0.25 1.32 -0.17 0.00 -0.96 0.00 0.00 56.93 57.36 1wuz s PHE 38 Cb -0.10 -3.82 0.03 0.00 -0.34 0.00 0.00 43.02 38.79 1wuz s PHE 38 CO 0.90 -2.36 0.37 0.50 -1.46 0.00 0.00 175.22 173.16 1wuz s ARG 39 N -2.01 0.72 0.03 10.12 6.06 0.52 -4.98 118.95 129.41 1wuz s ARG 39 Ca 0.52 -0.10 0.07 0.00 -2.50 0.00 0.00 55.73 53.72 1wuz s ARG 39 Cb -0.42 0.32 -0.02 0.00 0.06 0.00 0.00 34.95 34.89 1wuz s ARG 39 CO 0.56 -0.20 -0.21 0.08 -2.50 0.00 0.00 175.30 173.03 1wuz s VAL 40 N -1.26 1.67 0.25 7.11 1.01 -1.26 -0.59 120.40 127.34 1wuz s VAL 40 Ca -0.13 -1.12 -0.22 0.00 0.00 0.00 0.00 61.98 60.51 1wuz s VAL 40 Cb -0.04 -1.44 0.04 0.00 0.00 0.00 0.00 36.38 34.94 1wuz s VAL 40 CO 0.05 0.28 0.82 0.00 0.00 0.00 0.00 175.10 176.25 1wuz s ALA 41 N -0.72 -1.31 0.10 5.51 0.00 -0.76 -4.89 121.76 119.69 1wuz s ALA 41 Ca 0.08 -0.24 -0.21 0.00 0.00 0.00 0.00 51.96 51.59 1wuz s ALA 41 Cb -0.09 0.76 0.05 0.00 0.00 0.00 0.00 23.12 23.85 1wuz s ALA 41 CO 0.01 -1.04 0.52 0.45 0.00 0.00 0.00 175.76 175.70 1wuz s SER 42 N -2.97 -0.43 0.00 0.00 0.15 -1.26 -1.36 113.70 107.83 1wuz s SER 42 Ca 0.13 -0.00 0.31 0.00 0.70 0.00 0.00 55.95 57.09 1wuz s SER 42 Cb -0.04 0.52 1.76 0.00 -1.71 0.00 0.00 66.02 66.55 1wuz s SER 42 CO 0.06 -0.83 2.16 0.29 1.20 0.00 0.00 173.24 176.12 1wuz n LYS 43 N -0.00 0.87 0.00 5.44 5.02 -1.26 -3.35 118.16 124.88 1wuz n LYS 43 Ca -0.17 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.08 1wuz n LYS 43 Cb 0.63 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 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 -1.03 0.00 0.00 4.39 8.00 -1.26 -4.91 116.55 121.73 1wuz n ASP 44 Ca 0.21 0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.73 1wuz n ASP 44 Cb 0.16 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.20 1wuz n ASP 44 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1wuz n ARG 45 N -1.26 1.35 -0.92 -1.24 5.12 -1.26 -5.00 116.66 113.44 1wuz n ARG 45 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1wuz n ARG 45 Cb 0.00 -0.89 0.00 0.00 -1.16 0.00 0.00 32.46 30.41 1wuz n ARG 45 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1wuz n GLY 46 N 2.09 0.38 0.00 -0.13 0.00 -1.21 -4.72 105.19 101.59 1wuz n GLY 46 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.28 0.36 -0.25 1.61 8.00 -1.26 -4.50 116.55 120.22 1wuz n ASP 47 Ca 0.00 -1.17 0.05 0.00 0.71 0.00 0.00 54.79 54.38 1wuz n ASP 47 Cb 0.14 0.00 0.18 0.00 -0.02 0.00 0.00 41.12 41.41 1wuz n ASP 47 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1wuz h LEU 48 N 0.00 0.18 -8.19 0.64 4.07 -1.94 -1.91 115.31 108.16 1wuz h LEU 48 Ca 0.00 0.12 -0.10 0.00 0.08 0.00 0.00 57.88 57.98 1wuz h LEU 48 Cb 0.86 0.12 -0.11 0.00 1.08 0.00 0.00 40.66 42.60 1wuz h LEU 48 CO 0.00 0.06 -0.25 -0.76 -1.08 0.00 0.00 178.44 176.41 1wuz s LEU 49 N -10.49 0.65 -0.10 1.67 1.02 -1.26 -1.88 118.68 108.30 1wuz s LEU 49 Ca -0.13 -0.94 -0.18 0.00 0.02 0.00 0.00 54.13 52.90 1wuz s LEU 49 Cb 0.20 1.39 0.04 0.00 0.02 0.00 0.00 46.19 47.85 1wuz s LEU 49 CO 0.76 -1.00 0.45 -1.61 0.02 0.00 0.00 176.35 174.97 1wuz s GLU 50 N -4.01 0.68 0.01 1.70 2.02 -1.07 -4.85 118.70 113.18 1wuz s GLU 50 Ca 0.22 0.30 -0.14 0.00 0.02 0.00 0.00 54.97 55.36 1wuz s GLU 50 Cb 0.02 0.32 -0.06 0.00 0.10 0.00 0.00 34.13 34.51 1wuz s GLU 50 CO 0.05 -0.15 0.41 0.54 0.02 0.00 0.00 175.26 176.13 1wuz s VAL 51 N -0.53 5.03 -0.34 2.63 0.11 -1.26 -2.41 120.40 123.63 1wuz s VAL 51 Ca -0.07 0.80 -0.13 0.00 -2.93 0.00 0.00 61.98 59.66 1wuz s VAL 51 Cb -0.03 -3.70 -0.01 0.00 -1.53 0.00 0.00 36.38 31.10 1wuz s VAL 51 CO 0.03 0.54 0.23 0.21 -3.33 0.00 0.00 175.10 172.79 1wuz s ASN 52 N -1.17 6.01 0.29 3.54 3.04 -0.85 -4.94 114.94 120.86 1wuz s ASN 52 Ca 0.25 -0.46 0.22 0.00 0.04 0.00 0.00 52.86 52.91 1wuz s ASN 52 Cb -0.16 -2.13 1.06 0.00 -1.54 0.00 0.00 41.25 38.48 1wuz s ASN 52 CO 0.14 -0.24 1.67 0.18 -3.04 0.00 0.00 177.10 175.81 1wuz n LEU 53 N 5.10 0.60 0.12 3.21 4.77 -1.26 -0.15 117.00 129.38 1wuz n LEU 53 Ca -0.13 0.71 -0.15 0.00 -0.03 0.00 0.00 56.01 56.41 1wuz n LEU 53 Cb 0.49 -0.71 -0.09 0.00 -2.33 0.00 0.00 43.42 40.79 1wuz n LEU 53 CO 0.37 -0.77 0.55 -0.61 -1.33 0.00 0.00 177.39 175.60 1wuz h GLN 54 N 0.00 -0.69 0.00 3.23 5.75 -1.93 -3.37 115.11 118.10 1wuz h GLN 54 Ca 0.00 0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.54 1wuz h GLN 54 Cb 0.16 0.16 -0.00 0.00 1.07 0.00 0.00 27.48 28.87 1wuz h GLN 54 CO 0.00 -0.46 -1.02 0.09 -2.65 0.00 0.00 178.83 174.79 1wuz n ASN 55 N -5.48 4.93 0.00 -0.69 4.13 -1.18 -5.03 115.26 111.93 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 0.40 0.67 0.00 0.00 -1.54 0.00 0.00 39.78 39.31 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 2.83 1.22 3.90 7.41 0.00 0.79 -4.98 105.19 116.35 1wuz n GLY 56 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 1wuz n GLY 56 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1wuz s ILE 57 N -2.00 5.04 -0.31 -0.61 1.10 -1.23 -3.69 121.20 119.50 1wuz s ILE 57 Ca 0.00 0.07 -0.17 0.00 -0.51 0.00 0.00 60.65 60.04 1wuz s ILE 57 Cb 0.00 -3.71 -0.02 0.00 0.15 0.00 0.00 42.46 38.89 1wuz s ILE 57 CO 0.00 -0.24 0.45 -0.22 -2.11 0.00 0.00 174.94 172.83 1wuz s LEU 58 N -3.33 4.23 -0.00 8.50 1.98 -1.26 -2.01 118.68 126.78 1wuz s LEU 58 Ca 0.44 0.12 0.03 0.00 -2.89 0.00 0.00 54.13 51.83 1wuz s LEU 58 Cb -0.11 -2.52 -0.03 0.00 0.66 0.00 0.00 46.19 44.19 1wuz s LEU 58 CO 0.28 -0.35 -0.09 0.72 -1.89 0.00 0.00 176.35 175.03 1wuz s PHE 59 N 2.24 2.84 0.43 5.38 -0.12 -1.01 -2.07 117.98 125.67 1wuz s PHE 59 Ca 0.17 -0.07 -0.24 0.00 -0.05 0.00 0.00 56.93 56.74 1wuz s PHE 59 Cb -0.16 -1.60 -0.08 0.00 -0.63 0.00 0.00 43.02 40.55 1wuz s PHE 59 CO 0.11 0.34 1.20 0.08 -0.05 0.00 0.00 175.22 176.91 1wuz s VAL 60 N -0.95 2.97 0.00 -2.49 1.01 -0.86 -2.61 120.40 117.47 1wuz s VAL 60 Ca 0.16 0.79 0.00 0.00 0.00 0.00 0.00 61.98 62.93 1wuz s VAL 60 Cb -0.11 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.84 1wuz s VAL 60 CO 0.06 0.05 0.00 -3.20 0.00 0.00 0.00 175.10 172.01 1wuz n ASN 61 N -0.17 0.00 -3.06 3.32 2.85 -1.02 -2.08 115.26 115.10 1wuz n ASN 61 Ca 0.06 0.00 -0.15 0.00 -0.11 0.00 0.00 54.58 54.37 1wuz n ASN 61 Cb 0.46 -0.01 0.13 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 -1.58 -2.12 -4.75 1.20 3.41 -0.72 -4.77 113.62 104.29 1wuz n SER 62 Ca 0.00 -0.69 -0.40 0.00 -0.26 0.00 0.00 58.87 57.52 1wuz n SER 62 Cb 0.00 -0.50 -0.05 0.00 -0.26 0.00 0.00 64.21 63.39 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 -4.18 4.76 -0.01 4.33 0.52 -1.26 -4.84 118.95 118.27 1wuz s ARG 63 Ca 0.35 1.60 0.13 0.00 -0.52 0.00 0.00 55.73 57.29 1wuz s ARG 63 Cb -0.04 -3.26 -0.17 0.00 0.52 0.00 0.00 34.95 31.99 1wuz s ARG 63 CO 0.28 0.38 0.37 -0.89 0.02 0.00 0.00 175.30 175.45 1wuz n ILE 64 N 1.54 0.00 -1.39 1.52 2.08 -1.26 -4.12 119.36 117.73 1wuz n ILE 64 Ca -0.01 -0.26 -0.38 0.00 0.56 0.00 0.00 62.75 62.66 1wuz n ILE 64 Cb 0.46 0.51 0.04 0.00 -0.75 0.00 0.00 39.64 39.90 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 -1.70 -1.44 -0.21 4.38 -0.08 -1.26 -2.86 116.55 113.37 1wuz n ASP 65 Ca -0.01 0.69 0.28 0.00 -1.51 0.00 0.00 54.79 54.24 1wuz n ASP 65 Cb 0.28 -1.14 0.69 0.00 2.34 0.00 0.00 41.12 43.29 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 0.07 0.07 -0.25 -0.67 0.11 -1.93 0.41 114.38 112.19 1wuz h ARG 66 Ca -0.45 -0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.62 1wuz h ARG 66 Cb 1.39 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 32.45 1wuz h ARG 66 CO 0.45 0.05 0.12 0.93 0.10 0.00 0.00 179.97 181.62 1wuz h GLU 67 N 0.07 0.35 0.00 0.08 5.08 -1.86 0.34 114.58 118.64 1wuz h GLU 67 Ca 0.46 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.74 1wuz h GLU 67 Cb 1.69 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.87 1wuz h GLU 67 CO -0.04 0.34 -0.21 1.49 -1.00 0.00 0.00 179.01 179.58 1wuz h GLU 68 N 0.27 0.00 0.00 2.33 4.57 -1.22 -3.41 114.58 117.12 1wuz h GLU 68 Ca 0.09 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1wuz h GLU 68 Cb 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 1wuz h GLU 68 CO -0.01 0.47 0.00 -0.11 -1.18 0.00 0.00 179.01 178.17 1wuz n LEU 69 N -4.66 0.00 0.07 1.64 -0.00 0.12 -4.90 117.00 109.28 1wuz n LEU 69 Ca -0.08 0.84 0.00 0.00 -0.00 0.00 0.00 56.01 56.77 1wuz n LEU 69 Cb 0.28 -0.34 0.00 0.00 -0.00 0.00 0.00 43.42 43.36 1wuz n LEU 69 CO 0.15 -0.34 0.00 0.00 -0.00 0.00 0.00 177.39 177.21 1wuz n GLY 71 N -1.45 0.61 0.09 0.00 0.00 0.11 -4.76 105.19 99.79 1wuz n GLY 71 Ca 0.00 -0.24 -0.11 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.53 0.66 -3.75 1.61 0.00 -1.26 -5.00 116.66 106.39 1wuz n ARG 72 Ca -0.17 0.22 -0.09 0.00 -0.00 0.00 0.00 57.85 57.80 1wuz n ARG 72 Cb 0.58 -1.71 -0.03 0.00 0.00 0.00 0.00 32.46 31.30 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 -6.09 -0.27 0.17 6.15 0.15 -1.26 -5.05 113.70 107.49 1wuz s SER 73 Ca -0.09 -0.50 -0.16 0.00 0.70 0.00 0.00 55.95 55.90 1wuz s SER 73 Cb 0.07 0.61 0.13 0.00 -1.71 0.00 0.00 66.02 65.12 1wuz s SER 73 CO 0.81 -1.10 1.67 0.00 1.20 0.00 0.00 173.24 175.82 1wuz h ALA 74 N 2.15 0.34 -2.72 5.45 0.00 -1.95 -3.41 119.26 119.13 1wuz h ALA 74 Ca -0.27 0.16 -0.64 0.00 0.00 0.00 0.00 54.91 54.16 1wuz h ALA 74 Cb 1.26 0.30 -0.06 0.00 0.00 0.00 0.00 17.79 19.29 1wuz h ALA 74 CO 0.35 -0.43 -0.42 -1.21 0.00 0.00 0.00 179.25 177.54 1wuz s GLU 75 N -6.20 3.53 -0.12 0.00 2.02 -1.26 -4.83 118.70 111.84 1wuz s GLU 75 Ca -0.14 -0.11 -0.08 0.00 0.02 0.00 0.00 54.97 54.67 1wuz s GLU 75 Cb 0.15 -3.12 0.04 0.00 0.10 0.00 0.00 34.13 31.30 1wuz s GLU 75 CO 0.71 0.69 0.29 0.00 0.02 0.00 0.00 175.26 176.98 1wuz s SER 77 N 0.91 6.26 -0.00 0.00 1.04 -1.26 -2.56 113.70 118.09 1wuz s SER 77 Ca -0.06 0.19 0.01 0.00 0.48 0.00 0.00 55.95 56.56 1wuz s SER 77 Cb -0.07 -1.88 -0.00 0.00 0.10 0.00 0.00 66.02 64.16 1wuz s SER 77 CO -0.06 0.11 -0.02 -0.63 0.98 0.00 0.00 173.24 173.61 1wuz s ILE 78 N -1.62 0.18 -0.03 -1.02 1.09 -0.29 -5.01 121.20 114.50 1wuz s ILE 78 Ca 0.34 -0.12 0.04 0.00 -1.10 0.00 0.00 60.65 59.81 1wuz s ILE 78 Cb -0.12 -0.16 -0.03 0.00 -1.06 0.00 0.00 42.46 41.09 1wuz s ILE 78 CO 0.28 0.04 -0.12 -1.00 -0.10 0.00 0.00 174.94 174.03 1wuz s HIS 79 N -0.08 2.75 0.03 3.97 3.76 -1.26 -1.66 115.29 122.80 1wuz s HIS 79 Ca 0.01 -0.13 -0.01 0.00 -0.15 0.00 0.00 55.06 54.78 1wuz s HIS 79 Cb -0.01 -1.61 -0.03 0.00 1.11 0.00 0.00 32.58 32.04 1wuz s HIS 79 CO -0.00 0.25 -0.03 -1.17 -0.85 0.00 0.00 174.74 172.95 1wuz s LEU 80 N -0.99 2.33 -0.09 0.89 0.20 0.79 -4.60 118.68 117.20 1wuz s LEU 80 Ca 0.13 -0.71 -0.01 0.00 0.69 0.00 0.00 54.13 54.23 1wuz s LEU 80 Cb -0.11 0.16 0.03 0.00 -0.43 0.00 0.00 46.19 45.84 1wuz s LEU 80 CO 0.03 -0.43 -0.03 -1.61 -0.29 0.00 0.00 176.35 174.01 1wuz s GLU 81 N -2.53 0.97 -0.45 1.98 8.01 -0.47 -2.19 118.70 124.03 1wuz s GLU 81 Ca -0.06 -0.04 -0.19 0.00 0.01 0.00 0.00 54.97 54.69 1wuz s GLU 81 Cb -0.02 -1.19 0.03 0.00 -4.31 0.00 0.00 34.13 28.64 1wuz s GLU 81 CO -0.05 -0.27 0.56 0.08 0.01 0.00 0.00 175.26 175.59 1wuz s VAL 82 N 1.80 4.94 -0.29 2.63 1.01 -1.07 -1.83 120.40 127.60 1wuz s VAL 82 Ca 0.04 -0.23 -0.25 0.00 0.00 0.00 0.00 61.98 61.53 1wuz s VAL 82 Cb -0.12 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.09 1wuz s VAL 82 CO -0.06 -0.59 0.87 -0.63 0.00 0.00 0.00 175.10 174.69 1wuz s ILE 83 N 2.51 4.75 -0.06 2.22 1.09 0.24 -2.09 121.20 129.87 1wuz s ILE 83 Ca 0.17 1.44 0.06 0.00 -1.10 0.00 0.00 60.65 61.22 1wuz s ILE 83 Cb -0.17 -4.20 -0.01 0.00 -1.06 0.00 0.00 42.46 37.02 1wuz s ILE 83 CO 0.15 -0.24 -0.23 0.68 -0.10 0.00 0.00 174.94 175.19 1wuz s VAL 84 N 3.07 2.21 -0.27 2.92 -7.23 -0.84 -0.35 120.40 119.91 1wuz s VAL 84 Ca 0.36 -1.02 -0.05 0.00 -1.81 0.00 0.00 61.98 59.47 1wuz s VAL 84 Cb -0.14 -1.81 0.01 0.00 0.56 0.00 0.00 36.38 35.00 1wuz s VAL 84 CO 0.11 0.57 0.02 -0.62 -0.31 0.00 0.00 175.10 174.87 1wuz s ASP 85 N -0.25 4.78 -0.26 4.85 -1.08 -0.56 -2.29 116.67 121.85 1wuz s ASP 85 Ca -0.01 -0.70 -0.08 0.00 -0.52 0.00 0.00 52.55 51.24 1wuz s ASP 85 Cb -0.13 -1.80 0.01 0.00 -1.46 0.00 0.00 42.92 39.54 1wuz s ASP 85 CO 0.03 -0.15 0.28 0.54 0.52 0.00 0.00 175.17 176.40 1wuz n ARG 86 N 4.80 -1.83 -1.63 4.34 5.12 -1.26 -3.36 116.66 122.84 1wuz n ARG 86 Ca -0.16 1.73 -0.33 0.00 -1.93 0.00 0.00 57.85 57.17 1wuz n ARG 86 Cb 0.48 -4.21 0.06 0.00 -1.16 0.00 0.00 32.46 27.63 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 -1.79 2.66 -0.42 5.56 0.04 -1.26 -4.25 135.00 135.53 1wuz s PRO 87 Ca 0.12 1.34 -0.19 0.00 0.04 0.00 0.00 61.00 62.31 1wuz s PRO 87 Cb -0.03 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.59 1wuz s PRO 87 CO 0.52 -1.35 0.53 -1.17 0.04 0.00 0.00 177.00 175.57 1wuz s LEU 88 N -5.14 4.65 0.00 -3.56 2.96 -1.25 -4.67 118.68 111.67 1wuz s LEU 88 Ca 0.65 -0.46 -0.18 0.00 -0.22 0.00 0.00 54.13 53.93 1wuz s LEU 88 Cb -0.20 -2.55 0.06 0.00 0.50 0.00 0.00 46.19 44.00 1wuz s LEU 88 CO 0.45 -0.65 0.83 0.00 -1.32 0.00 0.00 176.35 175.66 1wuz n GLN 89 N 5.90 0.22 -4.22 1.98 1.13 -0.97 -5.03 117.38 116.38 1wuz n GLN 89 Ca -0.05 -0.68 -0.19 0.00 -1.94 0.00 0.00 57.00 54.14 1wuz n GLN 89 Cb 0.48 1.03 -0.12 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 -2.11 1.32 -0.19 5.09 1.01 -1.26 -1.98 120.40 122.28 1wuz s VAL 90 Ca 0.19 -1.55 -0.02 0.00 0.00 0.00 0.00 61.98 60.60 1wuz s VAL 90 Cb -0.01 -1.38 -0.00 0.00 0.00 0.00 0.00 36.38 34.99 1wuz s VAL 90 CO 0.01 -0.30 -0.10 -0.36 0.00 0.00 0.00 175.10 174.35 1wuz s PHE 91 N -1.69 2.88 -0.03 5.22 0.08 -0.89 -4.92 117.98 118.62 1wuz s PHE 91 Ca 0.05 -1.11 -0.30 0.00 0.12 0.00 0.00 56.93 55.69 1wuz s PHE 91 Cb -0.07 -2.01 -0.05 0.00 -0.57 0.00 0.00 43.02 40.32 1wuz s PHE 91 CO 0.03 -0.58 1.39 -1.01 -0.10 0.00 0.00 175.22 174.95 1wuz s HIS 92 N 1.26 2.79 -0.02 0.36 3.76 0.29 -2.59 115.29 121.13 1wuz s HIS 92 Ca 0.03 0.82 0.02 0.00 -0.15 0.00 0.00 55.06 55.77 1wuz s HIS 92 Cb -0.14 -3.64 0.01 0.00 1.11 0.00 0.00 32.58 29.91 1wuz s HIS 92 CO -0.05 -2.38 -0.06 0.08 -0.85 0.00 0.00 174.74 171.48 1wuz s VAL 93 N 2.71 0.56 -0.22 -0.90 1.01 -0.93 -0.22 120.40 122.41 1wuz s VAL 93 Ca 0.63 -0.22 -0.03 0.00 0.00 0.00 0.00 61.98 62.36 1wuz s VAL 93 Cb -0.30 -0.52 0.07 0.00 0.00 0.00 0.00 36.38 35.63 1wuz s VAL 93 CO 0.25 0.19 0.07 -1.61 0.00 0.00 0.00 175.10 174.00 1wuz s GLU 94 N 0.37 0.46 -0.11 2.72 2.02 0.50 -0.15 118.70 124.51 1wuz s GLU 94 Ca -0.05 -0.44 -0.06 0.00 0.02 0.00 0.00 54.97 54.44 1wuz s GLU 94 Cb -0.09 -1.90 -0.04 0.00 0.10 0.00 0.00 34.13 32.20 1wuz s GLU 94 CO 0.00 -0.74 0.10 0.14 0.02 0.00 0.00 175.26 174.78 1wuz s VAL 95 N 1.92 5.16 0.19 2.63 -7.23 -0.66 -1.98 120.40 120.43 1wuz s VAL 95 Ca 0.02 0.08 0.10 0.00 -1.81 0.00 0.00 61.98 60.37 1wuz s VAL 95 Cb -0.17 -3.23 -0.04 0.00 0.56 0.00 0.00 36.38 33.50 1wuz s VAL 95 CO -0.14 0.61 -0.14 -1.83 -0.31 0.00 0.00 175.10 173.29 1wuz s GLU 96 N -0.95 1.89 0.31 4.82 -1.05 -1.10 -1.14 118.70 121.47 1wuz s GLU 96 Ca 0.14 -1.36 -0.17 0.00 -0.15 0.00 0.00 54.97 53.43 1wuz s GLU 96 Cb -0.12 -2.05 -0.09 0.00 -0.44 0.00 0.00 34.13 31.43 1wuz s GLU 96 CO 0.03 0.42 0.76 0.14 0.95 0.00 0.00 175.26 177.56 1wuz s VAL 97 N -1.72 4.61 -0.37 1.83 -7.23 -1.06 -1.90 120.40 114.56 1wuz s VAL 97 Ca 0.24 1.10 0.01 0.00 -1.81 0.00 0.00 61.98 61.52 1wuz s VAL 97 Cb -0.08 -3.68 0.14 0.00 0.56 0.00 0.00 36.38 33.31 1wuz s VAL 97 CO 0.14 -0.09 0.22 -0.60 -0.31 0.00 0.00 175.10 174.46 1wuz s ARG 98 N -2.71 0.67 0.00 4.82 3.52 -0.30 -4.72 118.95 120.23 1wuz s ARG 98 Ca 0.52 -1.47 0.00 0.00 -0.13 0.00 0.00 55.73 54.65 1wuz s ARG 98 Cb -0.12 -1.45 0.00 0.00 -1.56 0.00 0.00 34.95 31.82 1wuz s ARG 98 CO 0.18 -1.21 0.00 -3.47 -0.81 0.00 0.00 175.30 169.99 1wuz n ASP 99 N 3.91 0.00 -4.93 -2.12 -0.08 -1.26 -2.38 116.55 109.69 1wuz n ASP 99 Ca 0.12 0.00 -0.26 0.00 -1.51 0.00 0.00 54.79 53.14 1wuz n ASP 99 Cb 0.37 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.81 1wuz n ASP 99 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1wuz s ILE 100 N -2.24 5.15 0.11 5.18 -1.09 -1.26 -4.87 121.20 122.17 1wuz s ILE 100 Ca 0.00 -0.36 -0.31 0.00 -2.23 0.00 0.00 60.65 57.75 1wuz s ILE 100 Cb 0.00 -3.78 -0.11 0.00 -1.58 0.00 0.00 42.46 37.00 1wuz s ILE 100 CO 0.00 -0.32 1.59 -0.55 -1.23 0.00 0.00 174.94 174.43 1wuz h ASN 101 N 1.53 -1.15 0.00 3.58 7.08 -1.93 -3.37 115.58 121.31 1wuz h ASN 101 Ca -0.49 0.12 -0.03 0.00 -3.08 0.00 0.00 56.30 52.82 1wuz h ASN 101 Cb 1.20 0.42 -0.01 0.00 -2.08 0.00 0.00 38.32 37.86 1wuz h ASN 101 CO 0.65 -0.49 -1.13 -0.67 -2.08 0.00 0.00 177.43 173.71 1wuz n ASP 102 N -5.46 4.52 0.00 6.14 -0.08 -1.26 -4.68 116.55 115.73 1wuz n ASP 102 Ca -0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.20 1wuz n ASP 102 Cb 0.37 0.56 0.00 0.00 2.34 0.00 0.00 41.12 44.39 1wuz n ASP 102 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12