#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lmb s LEU 7 N 0.00 2.70 0.79 2.45 1.43 -1.26 -5.06 118.68 119.73 1lmb s LEU 7 Ca 0.00 0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 53.53 1lmb s LEU 7 Cb 0.00 -3.09 0.07 0.00 0.03 0.00 0.00 46.19 43.19 1lmb s LEU 7 CO 0.00 -1.78 1.09 0.42 0.23 0.00 0.00 176.35 176.31 1lmb s THR 8 N -3.40 3.17 0.24 5.49 -4.23 -1.26 -4.80 115.64 110.85 1lmb s THR 8 Ca 0.62 0.38 -0.06 0.00 -1.18 0.00 0.00 61.69 61.45 1lmb s THR 8 Cb -0.10 -3.09 0.23 0.00 1.34 0.00 0.00 72.50 70.88 1lmb s THR 8 CO 0.47 -0.50 1.88 -0.61 -0.54 0.00 0.00 174.62 175.32 1lmb h GLN 9 N -1.09 1.09 -0.62 3.99 5.75 -1.99 0.31 115.11 122.56 1lmb h GLN 9 Ca -0.47 -0.07 -0.07 0.00 -0.15 0.00 0.00 58.65 57.90 1lmb h GLN 9 Cb 1.26 -0.25 -0.02 0.00 1.07 0.00 0.00 27.48 29.54 1lmb h GLN 9 CO 0.58 0.72 0.12 1.49 -2.65 0.00 0.00 178.83 179.09 1lmb h GLU 10 N 1.12 1.01 -0.82 1.69 4.81 -1.99 -0.96 114.58 119.43 1lmb h GLU 10 Ca 0.37 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.32 1lmb h GLU 10 Cb 0.05 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.26 1lmb h GLU 10 CO -0.13 0.93 0.43 1.96 -0.73 0.00 0.00 179.01 181.47 1lmb h GLN 11 N 0.92 1.16 -0.39 1.92 4.20 -1.73 -0.77 115.11 120.41 1lmb h GLN 11 Ca 0.19 -0.14 -0.10 0.00 0.06 0.00 0.00 58.65 58.66 1lmb h GLN 11 Cb 0.40 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 1lmb h GLN 11 CO 0.01 0.86 -0.15 -0.07 -0.67 0.00 0.00 178.83 178.81 1lmb h LEU 12 N 1.16 0.71 -0.45 1.46 3.38 -0.45 -2.02 115.31 119.09 1lmb h LEU 12 Ca 0.29 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1lmb h LEU 12 Cb 0.06 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1lmb h LEU 12 CO -0.04 0.88 0.09 -0.33 0.09 0.00 0.00 178.44 179.13 1lmb h GLU 13 N 0.65 0.74 -0.49 1.13 5.08 -0.36 -0.90 114.58 120.43 1lmb h GLU 13 Ca 0.10 -0.19 0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1lmb h GLU 13 Cb 0.62 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.73 1lmb h GLU 13 CO 0.04 0.74 0.22 -0.44 -1.00 0.00 0.00 179.01 178.58 1lmb h ASP 14 N 0.61 0.30 -0.45 1.42 5.19 -1.03 0.90 116.42 123.36 1lmb h ASP 14 Ca 0.14 0.04 -0.07 0.00 -0.62 0.00 0.00 57.03 56.52 1lmb h ASP 14 Cb 0.35 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.82 1lmb h ASP 14 CO 0.00 0.21 0.05 0.00 -3.12 0.00 0.00 179.24 176.38 1lmb h ALA 15 N 1.28 1.12 -0.54 3.45 0.00 -1.07 -0.80 119.26 122.70 1lmb h ALA 15 Ca 0.22 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1lmb h ALA 15 Cb 0.16 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1lmb h ALA 15 CO -0.18 0.57 -0.12 0.00 0.00 0.00 0.00 179.25 179.52 1lmb h ARG 16 N 0.78 1.04 -0.18 0.00 3.08 -0.22 -1.72 114.38 117.16 1lmb h ARG 16 Ca 0.16 -0.39 -0.01 0.00 0.07 0.00 0.00 59.98 59.80 1lmb h ARG 16 Cb 0.40 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1lmb h ARG 16 CO 0.01 1.09 0.07 0.00 -1.07 0.00 0.00 179.97 180.07 1lmb h ARG 17 N 0.92 0.28 -0.06 0.04 3.08 -0.56 -2.29 114.38 115.78 1lmb h ARG 17 Ca 0.14 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.16 1lmb h ARG 17 Cb 0.70 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.68 1lmb h ARG 17 CO 0.05 0.36 -0.08 1.25 -1.07 0.00 0.00 179.97 180.49 1lmb h LEU 18 N 0.13 -0.24 -1.32 3.04 5.85 -1.08 -1.96 115.31 119.73 1lmb h LEU 18 Ca 0.06 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 1lmb h LEU 18 Cb 0.19 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1lmb h LEU 18 CO -0.00 -0.11 -0.07 0.50 -0.34 0.00 0.00 178.44 178.41 1lmb h LYS 19 N -0.11 0.37 -0.73 1.25 3.64 -1.29 -2.13 116.57 117.57 1lmb h LYS 19 Ca 0.05 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 1lmb h LYS 19 Cb 0.18 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 1lmb h LYS 19 CO -0.13 0.46 0.27 0.00 -2.27 0.00 0.00 179.45 177.78 1lmb h ALA 20 N 1.58 0.95 -0.32 5.00 0.00 -1.10 0.13 119.26 125.50 1lmb h ALA 20 Ca 0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1lmb h ALA 20 Cb 0.35 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1lmb h ALA 20 CO 0.02 0.60 0.08 0.82 0.00 0.00 0.00 179.25 180.77 1lmb h ILE 21 N 1.06 1.22 -0.74 0.00 2.04 -0.93 -1.75 117.51 118.41 1lmb h ILE 21 Ca 0.24 -0.72 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 1lmb h ILE 21 Cb 0.25 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.38 1lmb h ILE 21 CO -0.02 0.24 0.42 0.22 0.00 0.00 0.00 178.15 179.02 1lmb h TYR 22 N 0.36 0.99 -0.21 1.37 3.20 -1.07 -0.82 116.97 120.78 1lmb h TYR 22 Ca 0.10 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 1lmb h TYR 22 Cb 0.28 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 1lmb h TYR 22 CO 0.01 0.68 -0.14 0.93 -1.64 0.00 0.00 178.16 178.00 1lmb h GLU 23 N 1.01 0.35 0.00 1.82 4.39 -0.54 -0.40 114.58 121.22 1lmb h GLU 23 Ca 0.26 -0.09 -0.22 0.00 0.34 0.00 0.00 59.36 59.65 1lmb h GLU 23 Cb 0.00 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 1lmb h GLU 23 CO -0.05 0.50 -1.08 -0.22 -1.16 0.00 0.00 179.01 177.01 1lmb h LYS 24 N 0.33 0.00 -0.01 2.33 3.64 -0.72 -3.35 116.57 118.79 1lmb h LYS 24 Ca 0.06 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1lmb h LYS 24 Cb 0.45 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1lmb h LYS 24 CO 0.03 0.94 -0.37 1.63 -2.27 0.00 0.00 179.45 179.41 1lmb n LYS 25 N -3.32 1.53 -0.26 1.90 5.02 -0.37 -4.62 118.16 118.04 1lmb n LYS 25 Ca -0.02 -0.90 0.02 0.00 -2.02 0.00 0.00 58.31 55.39 1lmb n LYS 25 Cb 0.95 -1.34 0.15 0.00 -0.02 0.00 0.00 35.03 34.77 1lmb n LYS 25 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1lmb h LYS 26 N 2.07 0.65 0.20 1.97 2.10 -1.21 -2.03 116.57 120.31 1lmb h LYS 26 Ca 0.00 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.60 1lmb h LYS 26 Cb 0.63 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 31.81 1lmb h LYS 26 CO 0.00 0.43 -0.09 -0.91 -2.00 0.00 0.00 179.45 176.87 1lmb h ASN 27 N 0.67 -0.22 -0.52 7.07 4.21 -1.85 -0.30 115.58 124.64 1lmb h ASN 27 Ca 0.37 -0.22 0.04 0.00 1.21 0.00 0.00 56.30 57.70 1lmb h ASN 27 Cb 0.38 0.06 -0.03 0.00 -1.12 0.00 0.00 38.32 37.61 1lmb h ASN 27 CO -0.27 0.12 0.34 1.05 -1.29 0.00 0.00 177.43 177.38 1lmb h GLU 28 N -0.58 0.54 -0.01 0.81 4.11 -1.84 -1.53 114.58 116.07 1lmb h GLU 28 Ca -0.03 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.37 1lmb h GLU 28 Cb 0.43 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1lmb h GLU 28 CO 0.04 0.35 -0.10 1.28 0.07 0.00 0.00 179.01 180.66 1lmb n LEU 29 N -4.47 1.55 -3.69 3.06 4.77 -0.77 -4.97 117.00 112.48 1lmb n LEU 29 Ca 0.06 -0.50 -0.24 0.00 -0.03 0.00 0.00 56.01 55.30 1lmb n LEU 29 Cb 0.17 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.28 1lmb n LEU 29 CO 0.35 0.27 0.12 0.61 -1.33 0.00 0.00 177.39 177.40 1lmb n GLY 30 N 1.26 -0.44 3.97 -0.72 0.00 -0.27 -5.01 105.19 103.96 1lmb n GLY 30 Ca 0.16 0.18 -0.19 0.00 0.00 0.00 0.00 46.02 46.17 1lmb n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lmb s LEU 31 N -7.00 3.95 0.18 0.99 1.43 -0.36 -5.03 118.68 112.84 1lmb s LEU 31 Ca 0.38 -0.21 -0.11 0.00 -1.03 0.00 0.00 54.13 53.16 1lmb s LEU 31 Cb -0.18 -2.68 -0.00 0.00 0.03 0.00 0.00 46.19 43.36 1lmb s LEU 31 CO 0.78 -0.38 0.36 -0.94 0.23 0.00 0.00 176.35 176.39 1lmb s SER 32 N -4.12 -0.04 0.41 2.29 1.04 -1.26 -4.80 113.70 107.21 1lmb s SER 32 Ca 0.43 -0.80 0.07 0.00 0.48 0.00 0.00 55.95 56.14 1lmb s SER 32 Cb -0.09 0.48 0.86 0.00 0.10 0.00 0.00 66.02 67.37 1lmb s SER 32 CO 0.30 -0.96 2.04 1.56 0.98 0.00 0.00 173.24 177.16 1lmb h GLN 33 N 2.43 0.49 -0.44 4.02 4.20 -2.00 -2.21 115.11 121.60 1lmb h GLN 33 Ca -0.30 -0.04 -0.13 0.00 0.06 0.00 0.00 58.65 58.23 1lmb h GLN 33 Cb 1.24 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.90 1lmb h GLN 33 CO 0.44 0.36 -0.24 0.93 -0.67 0.00 0.00 178.83 179.65 1lmb h GLU 34 N 0.50 0.94 -0.27 1.46 5.08 -1.94 -0.94 114.58 119.39 1lmb h GLU 34 Ca 0.13 -0.42 -0.13 0.00 -1.00 0.00 0.00 59.36 57.93 1lmb h GLU 34 Cb 0.01 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1lmb h GLU 34 CO -0.02 1.08 -0.38 0.66 -1.00 0.00 0.00 179.01 179.35 1lmb h SER 35 N 0.77 0.66 -0.28 1.42 4.64 -1.89 0.30 113.55 119.17 1lmb h SER 35 Ca 0.09 -0.29 -0.04 0.00 -0.47 0.00 0.00 61.79 61.08 1lmb h SER 35 Cb 0.82 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 1lmb h SER 35 CO 0.07 0.98 0.01 0.58 -0.87 0.00 0.00 176.83 177.60 1lmb h VAL 36 N 0.52 1.25 -0.62 0.95 2.07 -1.38 -1.53 116.25 117.51 1lmb h VAL 36 Ca 0.05 -0.89 0.05 0.00 0.82 0.00 0.00 66.70 66.73 1lmb h VAL 36 Cb 0.90 1.28 -0.05 0.00 -1.52 0.00 0.00 31.29 31.90 1lmb h VAL 36 CO 0.08 0.29 0.34 0.00 0.02 0.00 0.00 177.57 178.29 1lmb h ALA 37 N 0.84 0.81 -0.47 1.67 0.00 -0.80 -1.95 119.26 119.36 1lmb h ALA 37 Ca 0.08 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.08 1lmb h ALA 37 Cb 0.40 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 1lmb h ALA 37 CO 0.01 0.01 0.14 -0.44 0.00 0.00 0.00 179.25 178.97 1lmb h ASP 38 N 0.64 0.10 0.11 0.00 3.32 -0.15 0.28 116.42 120.71 1lmb h ASP 38 Ca 0.27 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.38 1lmb h ASP 38 Cb 0.15 0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 1lmb h ASP 38 CO -0.17 0.09 -0.05 0.11 -1.72 0.00 0.00 179.24 177.50 1lmb h LYS 39 N 0.29 0.00 -0.17 3.56 1.57 -0.77 -2.28 116.57 118.77 1lmb h LYS 39 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1lmb h LYS 39 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1lmb h LYS 39 CO -0.26 0.05 0.00 -1.33 -0.57 0.00 0.00 179.45 177.34 1lmb n MET 40 N -3.96 2.07 -1.95 3.15 2.81 -0.59 -4.94 117.12 113.71 1lmb n MET 40 Ca -0.03 -1.91 -0.04 0.00 -1.81 0.00 0.00 57.70 53.91 1lmb n MET 40 Cb 0.14 -1.42 -0.00 0.00 -0.71 0.00 0.00 33.22 31.23 1lmb n MET 40 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1lmb n GLY 41 N 1.21 0.27 0.00 3.03 0.00 -0.54 -5.03 105.19 104.13 1lmb n GLY 41 Ca 0.14 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1lmb n GLY 41 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1lmb n MET 42 N -1.57 1.18 -4.14 1.61 0.00 0.88 -5.01 117.12 110.07 1lmb n MET 42 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 57.70 57.43 1lmb n MET 42 Cb 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 33.22 33.66 1lmb n MET 42 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1lmb s GLY 43 N -0.44 1.45 0.26 3.17 0.00 -1.26 -3.97 107.32 106.53 1lmb s GLY 43 Ca 0.00 -1.46 -0.01 0.00 0.00 0.00 0.00 44.72 43.25 1lmb s GLY 43 CO 0.00 -1.50 1.71 -1.61 0.00 0.00 0.00 173.10 171.70 1lmb h GLN 44 N 1.56 0.39 -0.59 2.90 -0.00 -1.87 -1.26 115.11 116.25 1lmb h GLN 44 Ca -0.48 -0.02 0.09 0.00 -0.00 0.00 0.00 58.65 58.24 1lmb h GLN 44 Cb 1.24 -0.09 -0.07 0.00 0.00 0.00 0.00 27.48 28.56 1lmb h GLN 44 CO 0.61 0.26 0.19 0.77 0.00 0.00 0.00 178.83 180.66 1lmb h SER 45 N 0.41 0.16 -0.49 -0.69 0.02 -1.96 0.14 113.55 111.13 1lmb h SER 45 Ca 0.47 0.08 -0.08 0.00 -0.84 0.00 0.00 61.79 61.43 1lmb h SER 45 Cb 0.81 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.41 1lmb h SER 45 CO -0.47 0.10 0.01 1.23 -1.14 0.00 0.00 176.83 176.56 1lmb h GLY 46 N 0.36 0.98 0.81 -3.77 0.00 -1.65 -1.24 103.07 98.55 1lmb h GLY 46 Ca 0.30 -0.68 -0.09 0.00 0.00 0.00 0.00 47.33 46.86 1lmb h GLY 46 CO -0.32 0.62 -0.27 -2.08 0.00 0.00 0.00 176.54 174.50 1lmb h VAL 47 N 0.85 1.36 -0.96 4.60 2.07 -0.94 -2.97 116.25 120.25 1lmb h VAL 47 Ca 0.16 -1.51 0.06 0.00 0.82 0.00 0.00 66.70 66.23 1lmb h VAL 47 Cb 0.48 1.95 -0.06 0.00 -1.52 0.00 0.00 31.29 32.14 1lmb h VAL 47 CO 0.02 0.45 0.62 1.23 0.02 0.00 0.00 177.57 179.92 1lmb h GLY 48 N 0.08 1.42 1.24 2.17 0.00 -0.59 -1.08 103.07 106.31 1lmb h GLY 48 Ca 0.01 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1lmb h GLY 48 CO 0.06 0.35 0.50 0.00 0.00 0.00 0.00 176.54 177.44 1lmb h ALA 49 N 1.47 1.42 -0.04 3.60 0.00 -1.11 -0.41 119.26 124.19 1lmb h ALA 49 Ca 0.40 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 1lmb h ALA 49 Cb 0.13 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1lmb h ALA 49 CO -0.15 0.52 -0.04 -0.07 0.00 0.00 0.00 179.25 179.51 1lmb h LEU 50 N 1.05 0.10 -1.81 0.00 3.38 -1.21 0.19 115.31 117.01 1lmb h LEU 50 Ca 0.28 -0.50 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1lmb h LEU 50 Cb -0.10 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1lmb h LEU 50 CO -0.06 0.58 0.03 -0.26 0.09 0.00 0.00 178.44 178.83 1lmb h PHE 51 N -0.38 0.15 -0.57 1.13 0.04 -0.94 -2.79 116.94 113.59 1lmb h PHE 51 Ca 0.01 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.78 1lmb h PHE 51 Cb 0.56 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.66 1lmb h PHE 51 CO 0.10 0.13 0.00 0.09 -0.60 0.00 0.00 178.31 178.03 1lmb n ASN 52 N -4.48 3.64 -2.21 2.17 3.02 -0.19 -4.52 115.26 112.69 1lmb n ASN 52 Ca -0.01 -2.19 -0.17 0.00 -0.03 0.00 0.00 54.58 52.17 1lmb n ASN 52 Cb 0.12 -0.47 0.01 0.00 -0.61 0.00 0.00 39.78 38.83 1lmb n ASN 52 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lmb n GLY 53 N 1.22 -0.29 0.12 7.41 0.00 -1.05 -4.93 105.19 107.66 1lmb n GLY 53 Ca 0.21 -0.11 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 1lmb n GLY 53 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1lmb n ILE 54 N -4.16 1.54 -4.21 -0.61 2.08 0.63 -4.72 119.36 109.91 1lmb n ILE 54 Ca -0.14 -0.20 -0.31 0.00 0.56 0.00 0.00 62.75 62.66 1lmb n ILE 54 Cb 0.62 -1.95 -0.09 0.00 -0.75 0.00 0.00 39.64 37.47 1lmb n ILE 54 CO 0.00 0.00 0.00 0.20 0.56 0.00 0.00 176.55 177.31 1lmb s ASN 55 N -7.12 4.92 0.43 4.38 0.01 -0.96 -4.83 114.94 111.76 1lmb s ASN 55 Ca -0.33 -0.17 -0.23 0.00 -0.71 0.00 0.00 52.86 51.42 1lmb s ASN 55 Cb 0.10 -1.16 -0.08 0.00 0.41 0.00 0.00 41.25 40.51 1lmb s ASN 55 CO 0.56 0.21 1.09 0.00 -1.51 0.00 0.00 177.10 177.44 1lmb s ALA 56 N -1.22 3.03 0.47 0.60 0.00 -1.26 -4.49 121.76 118.88 1lmb s ALA 56 Ca 0.23 0.77 -0.19 0.00 0.00 0.00 0.00 51.96 52.77 1lmb s ALA 56 Cb -0.12 -3.31 -0.09 0.00 0.00 0.00 0.00 23.12 19.61 1lmb s ALA 56 CO 0.15 -0.36 0.97 -0.51 0.00 0.00 0.00 175.76 176.01 1lmb s LEU 57 N -2.84 3.79 0.41 0.00 1.43 -1.26 -5.03 118.68 115.19 1lmb s LEU 57 Ca 0.60 1.65 0.04 0.00 -1.03 0.00 0.00 54.13 55.39 1lmb s LEU 57 Cb -0.24 -4.53 -0.05 0.00 0.03 0.00 0.00 46.19 41.41 1lmb s LEU 57 CO 0.29 -0.49 0.04 0.54 0.23 0.00 0.00 176.35 176.96 1lmb s ASN 58 N -2.57 3.36 0.23 2.29 2.20 -1.26 -5.00 114.94 114.18 1lmb s ASN 58 Ca 0.61 -1.49 -0.07 0.00 -0.94 0.00 0.00 52.86 50.97 1lmb s ASN 58 Cb -0.10 0.06 0.31 0.00 -2.00 0.00 0.00 41.25 39.52 1lmb s ASN 58 CO 0.22 -0.67 1.82 0.00 -2.94 0.00 0.00 177.10 175.52 1lmb h ALA 59 N 1.76 1.04 0.58 3.54 0.00 -1.98 -1.89 119.26 122.31 1lmb h ALA 59 Ca -0.42 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 1lmb h ALA 59 Cb 1.26 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.91 1lmb h ALA 59 CO 0.72 0.11 -0.28 -0.92 0.00 0.00 0.00 179.25 178.89 1lmb h TYR 60 N 0.78 -0.72 -0.67 0.00 3.20 -1.99 -1.22 116.97 116.35 1lmb h TYR 60 Ca 0.34 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.17 1lmb h TYR 60 Cb 0.24 0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.71 1lmb h TYR 60 CO -0.06 -0.41 0.29 -0.91 -1.64 0.00 0.00 178.16 175.42 1lmb h ASN 61 N -0.88 0.88 -0.39 -2.11 2.35 -1.98 -0.26 115.58 113.18 1lmb h ASN 61 Ca -0.08 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.54 1lmb h ASN 61 Cb 0.64 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 1lmb h ASN 61 CO 0.13 0.77 0.17 0.00 -1.65 0.00 0.00 177.43 176.85 1lmb h ALA 62 N 1.36 0.51 -0.83 -0.83 0.00 -1.32 -1.55 119.26 116.60 1lmb h ALA 62 Ca 0.23 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1lmb h ALA 62 Cb 0.15 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1lmb h ALA 62 CO -0.02 0.09 0.44 0.00 0.00 0.00 0.00 179.25 179.76 1lmb h ALA 63 N 1.02 1.07 -0.12 0.00 0.00 -0.63 -0.75 119.26 119.85 1lmb h ALA 63 Ca 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1lmb h ALA 63 Cb 0.15 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1lmb h ALA 63 CO -0.01 0.59 0.05 -0.07 0.00 0.00 0.00 179.25 179.81 1lmb h LEU 64 N 1.16 0.16 -0.65 0.00 3.38 -0.87 -2.41 115.31 116.09 1lmb h LEU 64 Ca 0.29 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 58.18 1lmb h LEU 64 Cb 0.05 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.70 1lmb h LEU 64 CO -0.04 0.26 0.33 -0.07 0.09 0.00 0.00 178.44 179.01 1lmb h LEU 65 N 0.05 0.47 -0.12 1.67 3.38 -1.06 0.22 115.31 119.91 1lmb h LEU 65 Ca 0.04 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.07 1lmb h LEU 65 Cb 0.15 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1lmb h LEU 65 CO -0.00 0.29 -0.00 0.00 0.09 0.00 0.00 178.44 178.82 1lmb h ALA 66 N 1.36 0.10 -0.47 1.53 0.00 -1.05 0.37 119.26 121.09 1lmb h ALA 66 Ca 0.30 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1lmb h ALA 66 Cb 0.24 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1lmb h ALA 66 CO -0.21 -0.46 0.17 0.87 0.00 0.00 0.00 179.25 179.62 1lmb h LYS 67 N 0.03 0.72 -0.83 0.00 1.57 -0.89 0.26 116.57 117.44 1lmb h LYS 67 Ca 0.05 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1lmb h LYS 67 Cb 0.07 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.23 1lmb h LYS 67 CO -0.09 0.67 0.42 0.82 -0.57 0.00 0.00 179.45 180.69 1lmb h ILE 68 N 0.63 1.25 -0.00 1.86 2.04 -0.15 -2.96 117.51 120.17 1lmb h ILE 68 Ca 0.16 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.35 1lmb h ILE 68 Cb 0.23 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1lmb h ILE 68 CO -0.01 0.29 -0.28 0.18 0.00 0.00 0.00 178.15 178.34 1lmb n LEU 69 N -4.32 0.30 -2.59 1.44 4.77 0.08 -4.96 117.00 111.71 1lmb n LEU 69 Ca 0.08 0.21 -0.14 0.00 -0.03 0.00 0.00 56.01 56.13 1lmb n LEU 69 Cb 0.12 -0.35 0.06 0.00 -2.33 0.00 0.00 43.42 40.92 1lmb n LEU 69 CO 0.39 0.07 0.13 0.29 -1.33 0.00 0.00 177.39 176.95 1lmb n LYS 70 N -1.48 -5.03 -4.35 3.23 5.02 -0.03 -5.02 118.16 110.50 1lmb n LYS 70 Ca 0.06 0.56 -0.20 0.00 -2.02 0.00 0.00 58.31 56.71 1lmb n LYS 70 Cb 0.34 -4.76 -0.09 0.00 -0.02 0.00 0.00 35.03 30.49 1lmb n LYS 70 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1lmb s VAL 71 N -3.22 0.27 0.14 -0.18 -7.23 -0.52 -5.04 120.40 104.62 1lmb s VAL 71 Ca 0.25 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.38 1lmb s VAL 71 Cb -0.11 -2.47 -0.05 0.00 0.56 0.00 0.00 36.38 34.30 1lmb s VAL 71 CO 0.49 0.00 0.37 -0.55 -0.31 0.00 0.00 175.10 175.10 1lmb s SER 72 N -3.41 6.48 0.26 4.85 0.15 -1.26 -4.33 113.70 116.43 1lmb s SER 72 Ca 0.35 0.56 -0.02 0.00 0.70 0.00 0.00 55.95 57.54 1lmb s SER 72 Cb 0.04 -2.08 0.48 0.00 -1.71 0.00 0.00 66.02 62.75 1lmb s SER 72 CO 0.20 0.05 1.79 0.58 1.20 0.00 0.00 173.24 177.06 1lmb h VAL 73 N 2.01 0.83 0.00 4.45 2.07 -1.92 -0.25 116.25 123.45 1lmb h VAL 73 Ca -0.46 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 66.81 1lmb h VAL 73 Cb 1.17 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1lmb h VAL 73 CO 0.73 0.14 0.00 -1.84 0.02 0.00 0.00 177.57 176.61 1lmb n GLU 74 N -4.78 0.09 0.20 1.57 0.00 -1.26 -0.59 120.64 115.87 1lmb n GLU 74 Ca 0.16 0.59 0.14 0.00 0.00 0.00 0.00 57.16 58.05 1lmb n GLU 74 Cb 0.36 -1.80 0.44 0.00 0.00 0.00 0.00 31.44 30.44 1lmb n GLU 74 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1lmb h GLU 75 N 0.00 0.00 0.00 3.44 5.08 -1.43 -3.35 114.58 118.32 1lmb h GLU 75 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1lmb h GLU 75 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1lmb h GLU 75 CO 0.00 0.00 -0.88 1.97 -1.00 0.00 0.00 179.01 179.10 1lmb n PHE 76 N -2.81 0.00 -3.49 4.33 1.16 -0.23 -4.88 117.46 111.55 1lmb n PHE 76 Ca 0.03 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.32 1lmb n PHE 76 Cb 0.39 0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 38.13 1lmb n PHE 76 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1lmb s SER 77 N -2.89 3.07 0.37 5.98 0.15 0.24 -4.35 113.70 116.28 1lmb s SER 77 Ca 0.00 -2.19 0.04 0.00 0.70 0.00 0.00 55.95 54.50 1lmb s SER 77 Cb 0.00 -0.46 0.71 0.00 -1.71 0.00 0.00 66.02 64.56 1lmb s SER 77 CO 0.00 -0.31 2.01 -0.65 1.20 0.00 0.00 173.24 175.49 1lmb h PRO 78 N 7.05 0.69 -0.48 5.44 0.10 -1.77 -2.12 132.00 140.91 1lmb h PRO 78 Ca 0.04 -0.05 -0.04 0.00 0.10 0.00 0.00 66.00 66.04 1lmb h PRO 78 Cb 0.97 -0.15 -0.02 0.00 0.10 0.00 0.00 31.00 31.90 1lmb h PRO 78 CO 0.29 0.48 0.14 0.66 0.10 0.00 0.00 178.00 179.68 1lmb h SER 79 N 0.71 0.71 -0.47 -2.05 4.64 -1.94 -1.44 113.55 113.71 1lmb h SER 79 Ca 0.19 -0.22 -0.12 0.00 -0.47 0.00 0.00 61.79 61.17 1lmb h SER 79 Cb -0.03 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.86 1lmb h SER 79 CO -0.04 0.74 -0.16 0.40 -0.87 0.00 0.00 176.83 176.90 1lmb h ILE 80 N 0.65 1.27 -0.87 0.95 2.04 -1.91 -1.80 117.51 117.84 1lmb h ILE 80 Ca 0.15 -1.31 0.07 0.00 1.00 0.00 0.00 64.86 64.77 1lmb h ILE 80 Cb 0.29 1.13 -0.06 0.00 -0.74 0.00 0.00 36.82 37.44 1lmb h ILE 80 CO -0.00 0.45 0.54 0.00 0.00 0.00 0.00 178.15 179.14 1lmb h ALA 81 N 0.87 1.21 -0.40 1.87 0.00 -1.27 -0.56 119.26 120.97 1lmb h ALA 81 Ca 0.11 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1lmb h ALA 81 Cb 0.73 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1lmb h ALA 81 CO 0.06 0.28 -0.05 -0.09 0.00 0.00 0.00 179.25 179.44 1lmb h ARG 82 N 0.98 0.67 -0.57 0.00 2.43 -0.85 -2.34 114.38 114.70 1lmb h ARG 82 Ca 0.39 -0.19 -0.09 0.00 -0.81 0.00 0.00 59.98 59.28 1lmb h ARG 82 Cb 0.19 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1lmb h ARG 82 CO -0.18 0.73 -0.01 1.49 -1.51 0.00 0.00 179.97 180.49 1lmb h GLU 83 N 0.63 1.00 -0.79 0.20 4.81 -0.35 -2.24 114.58 117.84 1lmb h GLU 83 Ca 0.12 -0.32 0.02 0.00 -0.13 0.00 0.00 59.36 59.05 1lmb h GLU 83 Cb 0.47 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 1lmb h GLU 83 CO 0.02 1.00 0.51 0.82 -0.73 0.00 0.00 179.01 180.64 1lmb h ILE 84 N 0.89 1.15 -0.19 2.32 2.04 -0.83 -2.17 117.51 120.72 1lmb h ILE 84 Ca 0.16 -0.35 -0.10 0.00 1.00 0.00 0.00 64.86 65.57 1lmb h ILE 84 Cb 0.55 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 1lmb h ILE 84 CO 0.03 0.19 -0.30 0.22 0.00 0.00 0.00 178.15 178.28 1lmb h TYR 85 N 1.02 0.42 0.00 1.37 3.20 -1.30 -1.81 116.97 119.88 1lmb h TYR 85 Ca 0.31 -0.09 -0.12 0.00 3.14 0.00 0.00 58.73 61.97 1lmb h TYR 85 Cb -0.04 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 1lmb h TYR 85 CO -0.02 0.64 -0.56 0.93 -1.64 0.00 0.00 178.16 177.51 1lmb h GLU 86 N 0.33 0.00 -0.05 1.82 5.08 -0.79 -2.42 114.58 118.54 1lmb h GLU 86 Ca 0.04 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.19 1lmb h GLU 86 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1lmb h GLU 86 CO 0.05 0.56 -0.86 0.52 -1.00 0.00 0.00 179.01 178.28 1lmb h MET 87 N 0.00 0.52 0.00 2.33 2.86 -1.10 -2.92 114.93 116.62 1lmb h MET 87 Ca -0.01 -0.49 -0.03 0.00 -2.06 0.00 0.00 59.70 57.11 1lmb h MET 87 Cb 1.13 0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.91 1lmb h MET 87 CO 0.07 1.12 -0.15 -0.92 1.06 0.00 0.00 176.91 178.09 1lmb h TYR 88 N 0.32 0.00 0.00 -0.22 3.20 -1.18 0.11 116.97 119.21 1lmb h TYR 88 Ca -0.07 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.80 1lmb h TYR 88 Cb 1.48 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.75 1lmb h TYR 88 CO 0.07 0.15 -0.00 0.93 -1.64 0.00 0.00 178.16 177.67 1lmb h GLU 89 N 0.00 0.00 -0.01 1.82 5.08 -1.23 0.15 114.58 120.38 1lmb h GLU 89 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1lmb h GLU 89 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1lmb h GLU 89 CO 0.02 0.00 -0.16 0.00 -1.00 0.00 0.00 179.01 177.87 1lmb n ALA 90 N -2.09 2.88 -0.04 3.43 0.00 0.40 -4.25 120.51 120.84 1lmb n ALA 90 Ca -0.03 -0.49 -0.05 0.00 0.00 0.00 0.00 53.44 52.87 1lmb n ALA 90 Cb 0.09 -1.05 -0.04 0.00 0.00 0.00 0.00 19.45 18.45 1lmb n ALA 90 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1lmb n VAL 91 N 0.02 0.47 0.00 0.00 0.24 -0.41 -5.14 118.33 113.50 1lmb n VAL 91 Ca 0.14 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 1lmb n VAL 91 Cb 0.40 -0.80 0.00 0.00 -1.47 0.00 0.00 33.84 31.97 1lmb n VAL 91 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49