#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1udv n GLU 3 N 0.00 5.09 0.00 -2.82 1.02 -1.26 -4.96 120.64 117.71 1udv n GLU 3 Ca 0.00 -4.22 0.00 0.00 -0.02 0.00 0.00 57.16 52.92 1udv n GLU 3 Cb 0.00 -2.54 0.00 0.00 -0.02 0.00 0.00 31.44 28.88 1udv n GLU 3 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1udv n LYS 4 N 0.69 3.32 -0.01 3.49 4.01 -1.26 -4.98 118.16 123.41 1udv n LYS 4 Ca 0.52 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.32 1udv n LYS 4 Cb 0.26 0.00 -0.00 0.00 -0.51 0.00 0.00 35.03 34.78 1udv n LYS 4 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1udv n LEU 5 N 0.00 0.00 -4.14 -0.35 7.99 -1.26 -4.47 117.00 114.77 1udv n LEU 5 Ca 0.00 0.01 -0.38 0.00 -0.01 0.00 0.00 56.01 55.63 1udv n LEU 5 Cb 0.00 -0.03 -0.09 0.00 -0.11 0.00 0.00 43.42 43.20 1udv n LEU 5 CO 0.00 -0.94 0.08 0.20 -1.51 0.00 0.00 177.39 175.22 1udv s ASN 6 N -4.01 5.50 -0.11 -1.43 0.01 -1.26 -5.06 114.94 108.57 1udv s ASN 6 Ca 0.00 -2.72 -0.10 0.00 -0.71 0.00 0.00 52.86 49.34 1udv s ASN 6 Cb 0.00 -1.92 -0.05 0.00 0.41 0.00 0.00 41.25 39.70 1udv s ASN 6 CO 0.00 -0.43 0.21 -0.70 -1.51 0.00 0.00 177.10 174.67 1udv s GLU 7 N 0.14 3.74 -0.15 -0.60 2.12 -1.26 -2.02 118.70 120.67 1udv s GLU 7 Ca 0.16 -0.00 0.02 0.00 0.36 0.00 0.00 54.97 55.51 1udv s GLU 7 Cb -0.19 -3.26 0.01 0.00 0.26 0.00 0.00 34.13 30.95 1udv s GLU 7 CO -0.04 0.63 -0.21 0.42 -0.54 0.00 0.00 175.26 175.53 1udv s ILE 8 N -0.67 2.16 -0.22 -3.70 1.01 0.73 -4.95 121.20 115.56 1udv s ILE 8 Ca 0.16 -0.94 -0.20 0.00 0.00 0.00 0.00 60.65 59.67 1udv s ILE 8 Cb -0.13 -1.88 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 1udv s ILE 8 CO 0.05 0.54 0.59 -0.69 0.00 0.00 0.00 174.94 175.44 1udv s VAL 9 N 0.88 5.04 -0.30 2.92 1.01 -1.26 -1.06 120.40 127.63 1udv s VAL 9 Ca -0.05 1.09 -0.29 0.00 0.00 0.00 0.00 61.98 62.73 1udv s VAL 9 Cb -0.15 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 1udv s VAL 9 CO -0.03 0.10 1.78 -0.69 0.00 0.00 0.00 175.10 176.26 1udv s VAL 10 N 2.03 3.50 0.36 2.92 1.01 0.27 -4.94 120.40 125.54 1udv s VAL 10 Ca 0.26 0.52 -0.11 0.00 0.00 0.00 0.00 61.98 62.65 1udv s VAL 10 Cb -0.16 -3.63 -0.07 0.00 0.00 0.00 0.00 36.38 32.52 1udv s VAL 10 CO 0.10 -0.38 0.72 -0.13 0.00 0.00 0.00 175.10 175.41 1udv s ARG 11 N 5.48 3.82 0.35 2.72 1.81 -1.26 -4.80 118.95 127.08 1udv s ARG 11 Ca 0.79 0.46 0.19 0.00 -1.72 0.00 0.00 55.73 55.44 1udv s ARG 11 Cb -0.23 -2.45 0.20 0.00 -0.45 0.00 0.00 34.95 32.02 1udv s ARG 11 CO 0.33 0.07 1.52 1.57 -0.68 0.00 0.00 175.30 178.11 1udv h LYS 12 N 1.65 0.00 0.00 3.54 2.10 -2.00 -3.29 116.57 118.57 1udv h LYS 12 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1udv h LYS 12 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1udv h LYS 12 CO 0.65 0.29 -0.41 0.25 -2.00 0.00 0.00 179.45 178.22 1udv n THR 13 N -3.18 0.02 -4.53 0.07 -2.24 -1.26 -4.81 114.28 98.35 1udv n THR 13 Ca 0.03 -0.01 -0.34 0.00 -2.27 0.00 0.00 64.05 61.46 1udv n THR 13 Cb 0.64 0.09 -0.12 0.00 -2.10 0.00 0.00 70.33 68.84 1udv n THR 13 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1udv s LYS 14 N -3.01 3.20 0.81 -0.78 1.02 -1.24 -5.11 119.74 114.63 1udv s LYS 14 Ca 0.11 -0.54 -0.12 0.00 0.02 0.00 0.00 55.97 55.45 1udv s LYS 14 Cb 0.18 -2.74 0.08 0.00 -0.52 0.00 0.00 37.83 34.82 1udv s LYS 14 CO 0.67 0.45 1.10 0.54 -0.92 0.00 0.00 175.35 177.19 1udv s ASN 15 N -0.23 4.40 0.21 2.83 2.20 -1.26 -4.74 114.94 118.35 1udv s ASN 15 Ca 0.04 1.28 -0.09 0.00 -0.94 0.00 0.00 52.86 53.15 1udv s ASN 15 Cb -0.13 -2.00 0.30 0.00 -2.00 0.00 0.00 41.25 37.42 1udv s ASN 15 CO 0.02 -2.03 1.75 0.58 -2.94 0.00 0.00 177.10 174.49 1udv h VAL 16 N -1.13 0.78 -0.52 3.54 2.07 -1.95 -2.31 116.25 116.73 1udv h VAL 16 Ca -0.47 -0.16 -0.04 0.00 0.82 0.00 0.00 66.70 66.85 1udv h VAL 16 Cb 1.27 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1udv h VAL 16 CO 0.59 0.08 0.15 -0.08 0.02 0.00 0.00 177.57 178.34 1udv h GLU 17 N 0.45 0.79 -0.26 1.57 4.57 -1.97 -0.91 114.58 118.82 1udv h GLU 17 Ca 0.32 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 58.35 1udv h GLU 17 Cb 0.39 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 1udv h GLU 17 CO -0.30 0.70 0.12 0.22 -1.18 0.00 0.00 179.01 178.57 1udv h ASP 18 N 0.77 0.34 -0.54 1.04 1.82 -1.79 -0.85 116.42 117.20 1udv h ASP 18 Ca 0.17 -0.12 0.01 0.00 -0.39 0.00 0.00 57.03 56.70 1udv h ASP 18 Cb 0.25 -0.09 -0.03 0.00 0.68 0.00 0.00 39.33 40.14 1udv h ASP 18 CO -0.01 0.37 0.35 0.45 -1.61 0.00 0.00 179.24 178.79 1udv h HIS 19 N 0.29 0.65 -0.41 0.28 3.86 -1.04 0.24 115.15 119.03 1udv h HIS 19 Ca 0.09 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.34 1udv h HIS 19 Cb 0.12 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.34 1udv h HIS 19 CO -0.02 0.40 0.22 0.28 0.86 0.00 0.00 177.93 179.66 1udv h VAL 20 N 0.70 1.00 -0.32 2.45 2.07 -0.91 -1.53 116.25 119.71 1udv h VAL 20 Ca 0.20 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.50 1udv h VAL 20 Cb -0.05 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1udv h VAL 20 CO -0.06 0.08 -0.12 -0.07 0.02 0.00 0.00 177.57 177.42 1udv h LEU 21 N 0.44 0.54 -0.70 2.57 3.38 -0.75 -2.38 115.31 118.40 1udv h LEU 21 Ca 0.17 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1udv h LEU 21 Cb 0.06 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1udv h LEU 21 CO -0.11 0.69 0.21 0.44 0.09 0.00 0.00 178.44 179.76 1udv h ASP 22 N 0.51 1.03 -0.41 -0.43 3.32 -0.37 -2.01 116.42 118.06 1udv h ASP 22 Ca 0.09 -0.21 -0.06 0.00 0.02 0.00 0.00 57.03 56.87 1udv h ASP 22 Cb 0.51 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1udv h ASP 22 CO 0.03 0.97 0.04 0.58 -1.72 0.00 0.00 179.24 179.14 1udv h VAL 23 N 1.04 1.25 -0.19 -1.35 2.07 -0.99 -2.77 116.25 115.32 1udv h VAL 23 Ca 0.22 -0.94 -0.04 0.00 0.82 0.00 0.00 66.70 66.76 1udv h VAL 23 Cb 0.32 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1udv h VAL 23 CO -0.00 0.32 -0.06 0.40 0.02 0.00 0.00 177.57 178.25 1udv h ILE 24 N 0.55 1.16 -0.87 4.57 2.04 -1.26 -0.34 117.51 123.35 1udv h ILE 24 Ca 0.12 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.33 1udv h ILE 24 Cb 0.42 1.09 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 1udv h ILE 24 CO 0.01 0.21 0.54 0.58 0.00 0.00 0.00 178.15 179.49 1udv h VAL 25 N 0.27 1.24 0.17 1.67 2.07 -1.09 0.40 116.25 120.97 1udv h VAL 25 Ca 0.06 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 1udv h VAL 25 Cb 0.29 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 1udv h VAL 25 CO 0.01 0.24 -0.08 -0.07 0.02 0.00 0.00 177.57 177.69 1udv h LEU 26 N 1.20 -0.19 -0.68 2.57 3.38 -1.05 -3.21 115.31 117.32 1udv h LEU 26 Ca 0.31 -0.31 0.15 0.00 0.09 0.00 0.00 57.88 58.12 1udv h LEU 26 Cb -0.08 0.05 -0.12 0.00 0.09 0.00 0.00 40.66 40.60 1udv h LEU 26 CO -0.06 0.25 -0.04 -0.26 0.09 0.00 0.00 178.44 178.42 1udv h PHE 27 N -0.68 -0.12 0.00 1.13 0.04 -0.70 -1.44 116.94 115.18 1udv h PHE 27 Ca -0.02 0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 1udv h PHE 27 Cb 0.49 0.16 -0.00 0.00 2.20 0.00 0.00 35.95 38.80 1udv h PHE 27 CO 0.06 -0.22 -0.04 -0.91 -0.60 0.00 0.00 178.31 176.60 1udv h ASN 28 N 0.08 0.00 -0.55 2.17 -0.26 -0.97 -1.90 115.58 114.16 1udv h ASN 28 Ca 0.35 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.09 1udv h ASN 28 Cb 0.59 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.85 1udv h ASN 28 CO -0.61 0.04 0.00 0.00 -1.06 0.00 0.00 177.43 175.80 1udv n GLN 29 N -3.64 2.28 0.00 0.81 10.64 -0.56 -4.91 117.38 121.99 1udv n GLN 29 Ca -0.02 -1.97 0.00 0.00 -1.83 0.00 0.00 57.00 53.18 1udv n GLN 29 Cb 0.14 -1.43 0.00 0.00 -0.86 0.00 0.00 30.24 28.09 1udv n GLN 29 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1udv n GLY 30 N 1.36 0.34 3.51 2.61 0.00 -0.71 -5.01 105.19 107.29 1udv n GLY 30 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1udv n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1udv s ILE 31 N -2.00 4.19 -0.43 -0.61 1.01 -1.10 -4.85 121.20 117.40 1udv s ILE 31 Ca 0.00 -0.82 0.26 0.00 0.00 0.00 0.00 60.65 60.09 1udv s ILE 31 Cb 0.00 -4.92 0.32 0.00 0.01 0.00 0.00 42.46 37.87 1udv s ILE 31 CO 0.00 -1.74 1.76 -2.24 0.00 0.00 0.00 174.94 172.71 1udv h ASP 32 N 9.51 0.00 -3.24 3.58 2.03 -1.85 -3.23 116.42 123.22 1udv h ASP 32 Ca 0.07 0.00 -0.60 0.00 -0.73 0.00 0.00 57.03 55.77 1udv h ASP 32 Cb 1.03 0.00 -0.35 0.00 -0.83 0.00 0.00 39.33 39.18 1udv h ASP 32 CO 1.28 0.00 -0.84 -0.70 -1.03 0.00 0.00 179.24 177.95 1udv s GLU 33 N -3.29 2.38 0.06 4.15 2.12 -1.26 0.10 118.70 122.96 1udv s GLU 33 Ca 0.06 -0.62 0.06 0.00 0.36 0.00 0.00 54.97 54.84 1udv s GLU 33 Cb 0.09 -2.01 -0.03 0.00 0.26 0.00 0.00 34.13 32.44 1udv s GLU 33 CO 0.57 -0.07 -0.17 0.08 -0.54 0.00 0.00 175.26 175.13 1udv s VAL 34 N 1.00 1.34 -0.21 3.70 1.01 0.08 -4.58 120.40 122.73 1udv s VAL 34 Ca -0.06 -1.25 -0.01 0.00 0.00 0.00 0.00 61.98 60.66 1udv s VAL 34 Cb -0.15 -1.22 0.01 0.00 0.00 0.00 0.00 36.38 35.02 1udv s VAL 34 CO -0.02 -0.05 -0.11 -0.63 0.00 0.00 0.00 175.10 174.29 1udv s ILE 35 N -1.04 2.76 -0.19 2.22 1.01 -0.85 -0.01 121.20 125.10 1udv s ILE 35 Ca 0.03 -0.78 -0.18 0.00 0.00 0.00 0.00 60.65 59.72 1udv s ILE 35 Cb -0.09 -2.26 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 1udv s ILE 35 CO 0.02 0.42 0.50 -0.76 0.00 0.00 0.00 174.94 175.12 1udv s LEU 36 N 1.37 4.16 -0.09 2.97 1.43 -0.28 -0.20 118.68 128.06 1udv s LEU 36 Ca 0.04 0.68 0.03 0.00 -1.03 0.00 0.00 54.13 53.85 1udv s LEU 36 Cb -0.14 -2.69 -0.01 0.00 0.03 0.00 0.00 46.19 43.38 1udv s LEU 36 CO -0.07 -0.15 -0.20 -0.75 0.23 0.00 0.00 176.35 175.41 1udv s LYS 37 N 1.47 2.92 -0.04 1.70 2.20 -0.22 -1.04 119.74 126.73 1udv s LYS 37 Ca 0.24 -0.81 0.01 0.00 -0.36 0.00 0.00 55.97 55.05 1udv s LYS 37 Cb -0.15 -2.36 0.02 0.00 -1.51 0.00 0.00 37.83 33.83 1udv s LYS 37 CO 0.10 0.31 -0.05 0.20 -0.36 0.00 0.00 175.35 175.55 1udv s GLY 38 N 0.05 0.44 0.05 5.54 0.00 -0.79 -0.57 107.32 112.05 1udv s GLY 38 Ca -0.08 -0.05 0.08 0.00 0.00 0.00 0.00 44.72 44.67 1udv s GLY 38 CO 0.05 0.39 -0.22 -0.51 0.00 0.00 0.00 173.10 172.82 1udv s THR 39 N 0.84 2.50 0.00 0.90 -4.23 -1.26 -0.64 115.64 113.75 1udv s THR 39 Ca -0.11 -1.33 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 1udv s THR 39 Cb -0.14 -2.03 0.00 0.00 1.34 0.00 0.00 72.50 71.67 1udv s THR 39 CO 0.00 0.32 0.00 0.61 -0.54 0.00 0.00 174.62 175.01 1udv n GLY 40 N 1.55 3.70 0.27 3.99 0.00 0.56 -1.75 105.19 113.50 1udv n GLY 40 Ca -0.17 -0.06 0.16 0.00 0.00 0.00 0.00 46.02 45.95 1udv n GLY 40 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1udv h ARG 41 N 0.00 0.00 0.00 1.61 0.11 -1.96 -2.45 114.38 111.70 1udv h ARG 41 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1udv h ARG 41 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1udv h ARG 41 CO 0.00 0.07 0.00 0.39 0.10 0.00 0.00 179.97 180.53 1udv n GLU 42 N -3.27 0.63 -0.22 0.08 4.71 -0.72 -3.03 120.64 118.82 1udv n GLU 42 Ca -0.01 0.02 -0.08 0.00 -0.01 0.00 0.00 57.16 57.09 1udv n GLU 42 Cb 0.28 -1.50 0.03 0.00 -1.01 0.00 0.00 31.44 29.24 1udv n GLU 42 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1udv h ILE 43 N 0.00 1.24 -0.60 -3.67 2.04 -1.55 -0.67 117.51 114.31 1udv h ILE 43 Ca 0.00 -0.83 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1udv h ILE 43 Cb 0.07 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 1udv h ILE 43 CO 0.00 0.32 0.35 0.28 0.00 0.00 0.00 178.15 179.10 1udv h SER 44 N 0.86 0.73 -0.72 1.72 0.02 -1.77 -2.52 113.55 111.86 1udv h SER 44 Ca 0.19 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1udv h SER 44 Cb 0.29 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 1udv h SER 44 CO -0.01 0.58 0.40 0.50 -1.14 0.00 0.00 176.83 177.16 1udv h LYS 45 N 0.81 1.01 -0.85 3.45 3.64 -1.59 -1.25 116.57 121.79 1udv h LYS 45 Ca 0.21 -0.12 0.05 0.00 -1.27 0.00 0.00 60.65 59.53 1udv h LYS 45 Cb -0.00 -0.20 -0.06 0.00 -0.41 0.00 0.00 32.23 31.56 1udv h LYS 45 CO -0.04 0.75 0.53 0.00 -2.27 0.00 0.00 179.45 178.43 1udv h ALA 46 N 1.20 1.16 -0.63 5.00 0.00 -0.72 0.13 119.26 125.39 1udv h ALA 46 Ca 0.25 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.06 1udv h ALA 46 Cb 0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1udv h ALA 46 CO -0.04 0.30 0.04 0.28 0.00 0.00 0.00 179.25 179.83 1udv h VAL 47 N 0.99 1.27 -0.88 0.00 2.07 -1.10 -1.81 116.25 116.79 1udv h VAL 47 Ca 0.36 -1.12 0.04 0.00 0.82 0.00 0.00 66.70 66.80 1udv h VAL 47 Cb 0.12 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 1udv h VAL 47 CO -0.16 0.41 0.56 0.44 0.02 0.00 0.00 177.57 178.85 1udv h ASP 48 N 1.00 0.93 -0.31 0.57 3.32 0.08 0.21 116.42 122.23 1udv h ASP 48 Ca 0.18 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 1udv h ASP 48 Cb 0.52 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1udv h ASP 48 CO 0.02 0.64 0.13 0.58 -1.72 0.00 0.00 179.24 178.90 1udv h VAL 49 N 1.09 1.17 -0.30 -1.35 2.07 -0.43 -1.94 116.25 116.56 1udv h VAL 49 Ca 0.35 -0.51 0.02 0.00 0.82 0.00 0.00 66.70 67.38 1udv h VAL 49 Cb 0.02 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1udv h VAL 49 CO -0.12 0.18 0.15 0.22 0.02 0.00 0.00 177.57 178.02 1udv h TYR 50 N 0.35 0.28 -0.93 1.57 3.20 -0.71 -0.81 116.97 119.93 1udv h TYR 50 Ca 0.10 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.03 1udv h TYR 50 Cb 0.16 -0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.29 1udv h TYR 50 CO -0.01 0.16 0.60 -0.91 -1.64 0.00 0.00 178.16 176.35 1udv h ASN 51 N 0.32 0.98 -0.43 -2.11 2.35 -0.76 0.25 115.58 116.18 1udv h ASN 51 Ca 0.12 -0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.78 1udv h ASN 51 Cb 0.04 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1udv h ASN 51 CO -0.08 0.66 -0.06 -1.28 -1.65 0.00 0.00 177.43 175.01 1udv h SER 52 N 1.14 0.85 -0.32 5.81 0.87 -1.02 -0.06 113.55 120.82 1udv h SER 52 Ca 0.38 -0.24 -0.05 0.00 -1.23 0.00 0.00 61.79 60.65 1udv h SER 52 Cb 0.05 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 1udv h SER 52 CO -0.14 0.95 0.02 0.25 -0.53 0.00 0.00 176.83 177.38 1udv h LEU 53 N 0.79 0.54 -1.05 2.23 5.85 -0.26 -2.75 115.31 120.66 1udv h LEU 53 Ca 0.14 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 1udv h LEU 53 Cb 0.56 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 1udv h LEU 53 CO 0.03 0.70 0.26 0.50 -0.34 0.00 0.00 178.44 179.60 1udv h LYS 54 N 0.36 0.94 -0.50 1.25 1.63 -0.22 -1.08 116.57 118.95 1udv h LYS 54 Ca 0.09 -0.15 -0.05 0.00 -0.85 0.00 0.00 60.65 59.69 1udv h LYS 54 Cb 0.42 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 1udv h LYS 54 CO 0.01 0.76 0.10 0.22 -3.45 0.00 0.00 179.45 177.09 1udv h ASP 55 N 0.93 0.72 0.51 4.20 3.58 -0.82 0.16 116.42 125.70 1udv h ASP 55 Ca 0.22 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.54 1udv h ASP 55 Cb 0.17 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.03 1udv h ASP 55 CO -0.02 0.73 -1.13 -2.11 -2.88 0.00 0.00 179.24 173.84 1udv n ARG 56 N -4.27 0.40 -0.00 0.28 1.85 -1.03 -4.31 116.66 109.57 1udv n ARG 56 Ca 0.03 0.00 0.07 0.00 -1.00 0.00 0.00 57.85 56.95 1udv n ARG 56 Cb 0.24 -1.64 -0.10 0.00 -1.05 0.00 0.00 32.46 29.91 1udv n ARG 56 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1udv n LEU 57 N -2.15 0.22 0.00 2.89 4.77 -0.44 -5.05 117.00 117.24 1udv n LEU 57 Ca 0.01 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 1udv n LEU 57 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1udv n LEU 57 CO 0.41 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1udv n GLY 58 N 1.57 2.97 0.06 -0.72 0.00 0.55 0.13 105.19 109.75 1udv n GLY 58 Ca -0.01 0.14 0.06 0.00 0.00 0.00 0.00 46.02 46.21 1udv n GLY 58 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1udv n ASP 59 N 3.73 0.25 0.06 1.61 8.00 -1.26 -2.56 116.55 126.38 1udv n ASP 59 Ca 0.00 0.60 0.11 0.00 0.71 0.00 0.00 54.79 56.21 1udv n ASP 59 Cb 0.00 -0.64 0.45 0.00 -0.02 0.00 0.00 41.12 40.91 1udv n ASP 59 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1udv n GLY 60 N -0.93 -1.34 3.08 0.44 0.00 0.12 -4.74 105.19 101.81 1udv n GLY 60 Ca 0.01 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 1udv n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1udv s VAL 61 N -3.12 0.83 -0.02 1.61 0.11 -1.06 -0.01 120.40 118.75 1udv s VAL 61 Ca 0.08 -0.77 0.04 0.00 -2.93 0.00 0.00 61.98 58.41 1udv s VAL 61 Cb 0.12 -0.76 -0.01 0.00 -1.53 0.00 0.00 36.38 34.20 1udv s VAL 61 CO 0.43 0.00 -0.14 -1.10 -3.33 0.00 0.00 175.10 170.97 1udv s GLN 62 N -0.86 1.24 -0.67 1.54 -0.21 -0.41 -4.87 119.66 115.42 1udv s GLN 62 Ca 0.00 -0.48 -0.23 0.00 0.02 0.00 0.00 55.36 54.67 1udv s GLN 62 Cb -0.06 -1.15 0.07 0.00 1.00 0.00 0.00 33.01 32.86 1udv s GLN 62 CO 0.00 0.25 0.98 -1.17 -2.12 0.00 0.00 175.29 173.24 1udv s LEU 63 N -0.14 4.37 0.08 2.90 2.96 -1.26 -1.52 118.68 126.06 1udv s LEU 63 Ca 0.02 -1.01 -0.33 0.00 -0.22 0.00 0.00 54.13 52.59 1udv s LEU 63 Cb -0.07 -2.42 -0.17 0.00 0.50 0.00 0.00 46.19 44.03 1udv s LEU 63 CO 0.00 -1.44 1.61 0.58 -1.32 0.00 0.00 176.35 175.77 1udv h VAL 64 N 5.98 0.23 -3.02 1.68 2.07 -1.25 -3.47 116.25 118.46 1udv h VAL 64 Ca -0.27 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.28 1udv h VAL 64 Cb 1.07 0.23 -0.08 0.00 -1.52 0.00 0.00 31.29 30.99 1udv h VAL 64 CO 1.18 0.00 0.21 0.54 0.02 0.00 0.00 177.57 179.52 1udv s ASN 65 N -4.43 -0.36 -0.11 0.57 4.22 -1.24 -5.02 114.94 108.57 1udv s ASN 65 Ca -0.18 -0.40 0.02 0.00 -2.14 0.00 0.00 52.86 50.17 1udv s ASN 65 Cb 0.04 0.68 0.01 0.00 1.28 0.00 0.00 41.25 43.26 1udv s ASN 65 CO 0.62 -1.20 -0.18 -0.69 -2.04 0.00 0.00 177.10 173.61 1udv s VAL 66 N -3.86 1.72 -0.13 3.54 1.01 -1.26 -2.03 120.40 119.38 1udv s VAL 66 Ca 0.08 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.28 1udv s VAL 66 Cb -0.04 -1.53 0.02 0.00 0.00 0.00 0.00 36.38 34.83 1udv s VAL 66 CO -0.00 0.48 -0.16 -1.10 0.00 0.00 0.00 175.10 174.32 1udv s GLN 67 N 0.76 2.43 0.09 2.72 -0.21 -0.21 -4.96 119.66 120.28 1udv s GLN 67 Ca -0.10 -0.63 0.07 0.00 0.02 0.00 0.00 55.36 54.72 1udv s GLN 67 Cb -0.16 -2.11 -0.04 0.00 1.00 0.00 0.00 33.01 31.70 1udv s GLN 67 CO 0.01 -0.13 -0.14 0.95 -2.12 0.00 0.00 175.29 173.86 1udv s THR 68 N 1.18 3.10 0.00 -0.19 -4.23 -1.26 0.41 115.64 114.65 1udv s THR 68 Ca -0.01 -1.29 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 1udv s THR 68 Cb -0.14 -2.41 0.00 0.00 1.34 0.00 0.00 72.50 71.29 1udv s THR 68 CO -0.06 0.18 0.00 0.61 -0.54 0.00 0.00 174.62 174.81 1udv n GLY 69 N 0.97 2.21 2.81 3.99 0.00 -0.80 -5.01 105.19 109.36 1udv n GLY 69 Ca -0.15 -0.85 -0.15 0.00 0.00 0.00 0.00 46.02 44.88 1udv n GLY 69 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1udv s SER 70 N 0.59 0.11 0.00 1.61 0.15 -1.26 -1.83 113.70 113.06 1udv s SER 70 Ca 0.00 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.67 1udv s SER 70 Cb 0.00 -0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.24 1udv s SER 70 CO 0.00 -0.09 0.00 -1.84 1.20 0.00 0.00 173.24 172.51 1udv n GLU 71 N 3.88 2.88 0.00 5.44 0.28 0.04 -4.94 120.64 128.22 1udv n GLU 71 Ca -0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.76 1udv n GLU 71 Cb 0.53 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.40 1udv n GLU 71 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 177.13 178.52 1udv n VAL 72 N 0.00 0.00 -4.83 3.84 3.14 -1.26 -2.50 118.33 116.71 1udv n VAL 72 Ca 0.00 0.40 0.00 0.00 -2.96 0.00 0.00 64.34 61.78 1udv n VAL 72 Cb 0.00 -1.33 0.00 0.00 -1.06 0.00 0.00 33.84 31.45 1udv n VAL 72 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1udv n ARG 73 N -2.07 0.00 0.00 1.45 5.12 -1.26 -4.04 116.66 115.86 1udv n ARG 73 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1udv n ARG 73 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1udv n ARG 73 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1udv n ASP 74 N -2.18 0.00 0.00 0.55 8.00 -1.26 -4.68 116.55 116.97 1udv n ASP 74 Ca 0.00 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.59 1udv n ASP 74 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1udv n ASP 74 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1udv n ARG 75 N -0.20 4.92 -4.36 -1.24 1.74 -1.26 -5.11 116.66 111.15 1udv n ARG 75 Ca 0.00 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.85 1udv n ARG 75 Cb 0.00 -0.56 -0.11 0.00 -1.02 0.00 0.00 32.46 30.76 1udv n ARG 75 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1udv s ARG 76 N -0.32 1.34 -0.09 5.56 1.70 -1.26 -5.09 118.95 120.80 1udv s ARG 76 Ca 0.00 -1.46 -0.29 0.00 -0.47 0.00 0.00 55.73 53.51 1udv s ARG 76 Cb 0.00 -1.44 -0.07 0.00 -0.57 0.00 0.00 34.95 32.88 1udv s ARG 76 CO 0.00 0.29 1.98 -0.98 -1.08 0.00 0.00 175.30 175.51 1udv s ARG 77 N -2.85 3.76 0.01 3.89 1.70 -1.26 -4.58 118.95 119.62 1udv s ARG 77 Ca 0.18 2.26 0.03 0.00 -0.47 0.00 0.00 55.73 57.72 1udv s ARG 77 Cb -0.06 -4.20 -0.04 0.00 -0.57 0.00 0.00 34.95 30.08 1udv s ARG 77 CO 0.08 -1.38 -0.04 -1.50 -1.08 0.00 0.00 175.30 171.38 1udv s ILE 78 N 5.81 3.88 0.53 4.99 2.07 -1.04 -4.89 121.20 132.54 1udv s ILE 78 Ca 0.89 -0.73 -0.16 0.00 -1.41 0.00 0.00 60.65 59.24 1udv s ILE 78 Cb -0.36 -2.72 -0.07 0.00 0.13 0.00 0.00 42.46 39.43 1udv s ILE 78 CO 0.37 0.36 0.99 -0.55 -1.91 0.00 0.00 174.94 174.20 1udv s SER 79 N -1.56 6.53 0.10 4.50 0.15 -1.26 -0.78 113.70 121.37 1udv s SER 79 Ca 0.19 1.57 -0.08 0.00 0.70 0.00 0.00 55.95 58.33 1udv s SER 79 Cb -0.11 -2.51 -0.01 0.00 -1.71 0.00 0.00 66.02 61.69 1udv s SER 79 CO 0.10 -0.65 0.19 -0.72 1.20 0.00 0.00 173.24 173.35 1udv s TYR 80 N -2.67 0.22 0.02 3.44 -0.85 -0.76 -0.33 117.35 116.42 1udv s TYR 80 Ca 0.59 -0.65 0.01 0.00 -0.52 0.00 0.00 57.07 56.51 1udv s TYR 80 Cb -0.10 -0.08 -0.02 0.00 0.38 0.00 0.00 41.96 42.14 1udv s TYR 80 CO 0.34 -0.56 -0.06 -1.50 -1.52 0.00 0.00 175.55 172.25 1udv s ILE 81 N -3.88 0.38 -0.12 -3.49 2.07 0.19 -1.90 121.20 114.44 1udv s ILE 81 Ca 0.07 -0.72 -0.01 0.00 -1.41 0.00 0.00 60.65 58.59 1udv s ILE 81 Cb 0.05 -0.42 0.03 0.00 0.13 0.00 0.00 42.46 42.25 1udv s ILE 81 CO -0.09 -0.23 -0.06 -0.76 -1.91 0.00 0.00 174.94 171.89 1udv s LEU 82 N -1.02 1.21 -0.34 8.50 1.43 0.17 -1.88 118.68 126.74 1udv s LEU 82 Ca -0.07 -0.36 -0.07 0.00 -1.03 0.00 0.00 54.13 52.60 1udv s LEU 82 Cb -0.07 -0.81 0.04 0.00 0.03 0.00 0.00 46.19 45.38 1udv s LEU 82 CO -0.00 -0.14 0.12 -0.76 0.23 0.00 0.00 176.35 175.79 1udv s LEU 83 N 1.72 4.38 -0.23 1.79 1.43 -0.20 -1.05 118.68 126.52 1udv s LEU 83 Ca 0.04 -1.14 -0.19 0.00 -1.03 0.00 0.00 54.13 51.81 1udv s LEU 83 Cb -0.13 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 1udv s LEU 83 CO -0.08 -0.34 0.57 -0.60 0.23 0.00 0.00 176.35 176.13 1udv s ARG 84 N 1.42 4.14 -0.01 1.70 3.52 -0.86 -1.12 118.95 127.73 1udv s ARG 84 Ca -0.01 0.47 0.03 0.00 -0.13 0.00 0.00 55.73 56.09 1udv s ARG 84 Cb -0.20 -3.61 -0.03 0.00 -1.56 0.00 0.00 34.95 29.55 1udv s ARG 84 CO 0.03 -0.29 -0.10 -0.51 -0.81 0.00 0.00 175.30 173.62 1udv s LEU 85 N 2.10 3.02 -0.07 -0.88 1.43 0.99 -0.66 118.68 124.60 1udv s LEU 85 Ca 0.25 -0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.19 1udv s LEU 85 Cb -0.16 -1.71 0.01 0.00 0.03 0.00 0.00 46.19 44.37 1udv s LEU 85 CO 0.09 0.30 -0.12 -0.75 0.23 0.00 0.00 176.35 176.11 1udv s LYS 86 N -1.21 1.71 -0.05 1.70 2.20 -0.57 -0.74 119.74 122.77 1udv s LYS 86 Ca 0.15 -0.40 -0.28 0.00 -0.36 0.00 0.00 55.97 55.08 1udv s LYS 86 Cb -0.11 -1.46 -0.03 0.00 -1.51 0.00 0.00 37.83 34.72 1udv s LYS 86 CO 0.05 -0.02 0.93 0.50 -0.36 0.00 0.00 175.35 176.45 1udv s ARG 87 N 0.83 4.49 0.04 4.03 6.06 0.11 -1.29 118.95 133.24 1udv s ARG 87 Ca -0.11 1.29 0.09 0.00 -2.50 0.00 0.00 55.73 54.50 1udv s ARG 87 Cb -0.15 -3.49 -0.03 0.00 0.06 0.00 0.00 34.95 31.34 1udv s ARG 87 CO 0.02 -0.11 -0.26 0.14 -2.50 0.00 0.00 175.30 172.59 1udv s VAL 88 N 1.29 2.21 -0.04 7.11 -7.23 0.99 -4.93 120.40 119.80 1udv s VAL 88 Ca 0.48 -1.37 0.00 0.00 -1.81 0.00 0.00 61.98 59.28 1udv s VAL 88 Cb -0.19 -1.87 0.00 0.00 0.56 0.00 0.00 36.38 34.88 1udv s VAL 88 CO 0.23 0.36 0.51 -1.22 -0.31 0.00 0.00 175.10 174.67