#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dno s SER 60 N 0.00 7.06 0.44 1.61 0.01 -1.26 -5.03 113.70 116.54 2dno s SER 60 Ca 0.00 -3.08 0.02 0.00 1.31 0.00 0.00 55.95 54.19 2dno s SER 60 Cb 0.00 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 63.96 2dno s SER 60 CO 0.00 -0.54 0.65 -0.94 0.41 0.00 0.00 173.24 172.82 2dno s SER 61 N 2.09 5.77 0.00 2.44 1.04 -1.26 -4.85 113.70 118.94 2dno s SER 61 Ca 0.30 0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.87 2dno s SER 61 Cb -0.08 -1.36 0.00 0.00 0.10 0.00 0.00 66.02 64.68 2dno s SER 61 CO -0.07 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.05 2dno n GLY 62 N -2.03 -0.71 3.91 7.32 0.00 -1.26 -5.07 105.19 107.35 2dno n GLY 62 Ca 0.02 -0.17 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 2dno n GLY 62 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dno s SER 63 N -0.83 6.26 0.47 1.61 0.15 -1.26 -5.05 113.70 115.05 2dno s SER 63 Ca 0.00 0.93 -0.22 0.00 0.70 0.00 0.00 55.95 57.35 2dno s SER 63 Cb 0.00 -2.25 -0.08 0.00 -1.71 0.00 0.00 66.02 61.99 2dno s SER 63 CO 0.00 -0.58 1.12 -0.44 1.20 0.00 0.00 173.24 174.54 2dno s SER 64 N -4.10 6.21 0.00 5.45 0.01 -1.26 -5.04 113.70 114.97 2dno s SER 64 Ca 0.47 2.18 0.00 0.00 1.31 0.00 0.00 55.95 59.92 2dno s SER 64 Cb -0.10 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.54 2dno s SER 64 CO 0.45 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 173.83 2dno n GLY 65 N 0.28 3.61 3.94 3.44 0.00 -1.26 -5.15 105.19 110.05 2dno n GLY 65 Ca 0.08 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 45.19 2dno n GLY 65 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dno s SER 66 N 1.00 5.33 -0.26 1.61 0.01 -1.26 -5.01 113.70 115.12 2dno s SER 66 Ca 0.00 0.44 -0.29 0.00 1.31 0.00 0.00 55.95 57.42 2dno s SER 66 Cb 0.00 -1.35 -0.02 0.00 0.21 0.00 0.00 66.02 64.87 2dno s SER 66 CO 0.00 -1.19 1.55 -0.13 0.41 0.00 0.00 173.24 173.88 2dno s ARG 67 N -4.97 3.77 0.00 12.44 1.81 -1.26 -4.83 118.95 125.91 2dno s ARG 67 Ca 0.56 1.51 0.00 0.00 -1.72 0.00 0.00 55.73 56.07 2dno s ARG 67 Cb -0.10 -4.02 0.00 0.00 -0.45 0.00 0.00 34.95 30.38 2dno s ARG 67 CO 0.43 -1.32 0.00 0.41 -0.68 0.00 0.00 175.30 174.13 2dno n GLY 68 N 4.68 0.38 3.20 -3.53 0.00 -1.26 -5.01 105.19 103.65 2dno n GLY 68 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 2dno n GLY 68 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dno n GLU 69 N -0.31 -5.08 -3.75 1.61 -0.58 -1.26 -4.95 120.64 106.32 2dno n GLU 69 Ca 0.00 0.81 -0.36 0.00 -0.42 0.00 0.00 57.16 57.19 2dno n GLU 69 Cb 0.00 -5.68 -0.10 0.00 -0.57 0.00 0.00 31.44 25.09 2dno n GLU 69 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2dno s ASP 70 N -2.81 5.21 0.27 1.62 -1.08 -1.26 -4.95 116.67 113.66 2dno s ASP 70 Ca 0.38 -2.62 -0.01 0.00 -0.52 0.00 0.00 52.55 49.78 2dno s ASP 70 Cb -0.17 -1.84 0.54 0.00 -1.46 0.00 0.00 42.92 39.99 2dno s ASP 70 CO 0.46 -0.42 1.77 0.03 0.52 0.00 0.00 175.17 177.54 2dno h ARG 71 N 7.31 0.67 -6.90 4.34 3.08 -1.93 -3.43 114.38 117.53 2dno h ARG 71 Ca -0.05 -0.04 -0.57 0.00 0.07 0.00 0.00 59.98 59.39 2dno h ARG 71 Cb 0.98 -0.15 0.15 0.00 0.08 0.00 0.00 29.97 31.03 2dno h ARG 71 CO 0.71 0.44 0.32 1.17 -1.07 0.00 0.00 179.97 181.54 2dno n LYS 72 N -4.83 1.23 -4.53 0.04 4.81 -1.26 -4.12 118.16 109.50 2dno n LYS 72 Ca 0.17 0.46 -0.21 0.00 -0.87 0.00 0.00 58.31 57.86 2dno n LYS 72 Cb 0.42 -2.31 -0.15 0.00 0.02 0.00 0.00 35.03 33.01 2dno n LYS 72 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2dno s LEU 73 N -2.48 2.07 -0.31 3.14 1.43 0.51 -3.15 118.68 119.89 2dno s LEU 73 Ca 0.73 -0.30 -0.17 0.00 -1.03 0.00 0.00 54.13 53.36 2dno s LEU 73 Cb -0.43 -0.66 -0.02 0.00 0.03 0.00 0.00 46.19 45.11 2dno s LEU 73 CO 0.48 0.13 0.47 0.12 0.23 0.00 0.00 176.35 177.78 2dno s PHE 74 N -0.47 3.22 -0.10 0.29 5.36 0.19 -1.48 117.98 124.98 2dno s PHE 74 Ca 0.04 0.31 -0.04 0.00 -0.96 0.00 0.00 56.93 56.28 2dno s PHE 74 Cb -0.06 -2.78 -0.04 0.00 -0.34 0.00 0.00 43.02 39.81 2dno s PHE 74 CO 0.00 -0.41 0.04 0.08 -1.46 0.00 0.00 175.22 173.48 2dno s VAL 75 N 2.27 4.68 0.35 3.12 1.01 -0.03 -1.68 120.40 130.12 2dno s VAL 75 Ca 0.18 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.09 2dno s VAL 75 Cb -0.16 -3.00 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 2dno s VAL 75 CO 0.11 0.60 0.16 -0.83 0.00 0.00 0.00 175.10 175.14 2dno s GLY 76 N -0.79 2.32 -1.16 4.51 0.00 0.19 -1.92 107.32 110.47 2dno s GLY 76 Ca 0.13 -1.61 -0.05 0.00 0.00 0.00 0.00 44.72 43.19 2dno s GLY 76 CO 0.03 -1.68 1.00 1.03 0.00 0.00 0.00 173.10 173.47 2dno n MET 77 N -0.73 -6.68 -3.70 2.90 2.81 -1.03 -2.08 117.12 108.62 2dno n MET 77 Ca -0.01 0.75 -0.20 0.00 -1.81 0.00 0.00 57.70 56.43 2dno n MET 77 Cb 0.65 -5.53 -0.01 0.00 -0.71 0.00 0.00 33.22 27.61 2dno n MET 77 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2dno s LEU 78 N -6.36 4.11 0.19 4.03 1.43 -1.17 -4.58 118.68 116.34 2dno s LEU 78 Ca 0.31 -0.09 0.09 0.00 -1.03 0.00 0.00 54.13 53.41 2dno s LEU 78 Cb -0.14 -2.78 -0.04 0.00 0.03 0.00 0.00 46.19 43.26 2dno s LEU 78 CO 0.65 -0.27 -0.17 -0.83 0.23 0.00 0.00 176.35 175.96 2dno s GLY 79 N -4.08 1.47 0.41 -3.19 0.00 -1.26 -4.37 107.32 96.30 2dno s GLY 79 Ca 0.40 -1.61 0.20 0.00 0.00 0.00 0.00 44.72 43.72 2dno s GLY 79 CO 0.30 -1.68 1.77 1.70 0.00 0.00 0.00 173.10 175.19 2dno h LYS 80 N 2.87 0.34 -0.53 2.90 1.63 -1.91 0.14 116.57 122.00 2dno h LYS 80 Ca -0.40 -0.02 0.05 0.00 -0.85 0.00 0.00 60.65 59.43 2dno h LYS 80 Cb 1.22 -0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 32.72 2dno h LYS 80 CO 0.56 0.22 0.25 1.96 -3.45 0.00 0.00 179.45 179.00 2dno h GLN 81 N 0.35 0.47 -6.53 1.90 4.20 -1.95 -3.41 115.11 110.14 2dno h GLN 81 Ca 0.60 -0.03 -0.53 0.00 0.06 0.00 0.00 58.65 58.76 2dno h GLN 81 Cb 1.61 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 29.29 2dno h GLN 81 CO -0.28 0.31 0.50 -0.65 -0.67 0.00 0.00 178.83 178.04 2dno s GLN 82 N -6.12 4.51 0.25 1.46 1.11 0.49 -4.97 119.66 116.39 2dno s GLN 82 Ca -0.13 1.70 0.01 0.00 0.01 0.00 0.00 55.36 56.95 2dno s GLN 82 Cb 0.14 -3.34 -0.05 0.00 -1.01 0.00 0.00 33.01 28.75 2dno s GLN 82 CO 0.74 -0.11 0.09 -0.08 0.01 0.00 0.00 175.29 175.94 2dno s THR 83 N 0.59 0.56 0.31 -0.19 -1.32 -1.26 -4.71 115.64 109.63 2dno s THR 83 Ca 0.54 -2.00 0.18 0.00 -1.21 0.00 0.00 61.69 59.21 2dno s THR 83 Cb -0.28 -2.60 0.30 0.00 -1.51 0.00 0.00 72.50 68.41 2dno s THR 83 CO 0.31 -0.03 1.32 -0.90 -2.21 0.00 0.00 174.62 173.11 2dno n ASP 84 N -0.45 0.29 0.21 8.08 5.75 -1.26 0.80 116.55 129.97 2dno n ASP 84 Ca -0.00 1.38 -0.15 0.00 -0.01 0.00 0.00 54.79 56.01 2dno n ASP 84 Cb 0.66 -0.67 -0.08 0.00 -1.03 0.00 0.00 41.12 40.00 2dno n ASP 84 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2dno h GLU 85 N 0.00 -0.50 0.24 0.11 3.07 -1.96 -0.58 114.58 114.95 2dno h GLU 85 Ca 0.71 0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.60 2dno h GLU 85 Cb 1.92 0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 29.93 2dno h GLU 85 CO -0.63 -0.24 -0.21 -0.44 -1.40 0.00 0.00 179.01 176.09 2dno h ASP 86 N -0.70 -0.58 -0.64 1.42 3.32 0.01 0.01 116.42 119.27 2dno h ASP 86 Ca -0.05 0.04 0.13 0.00 0.02 0.00 0.00 57.03 57.17 2dno h ASP 86 Cb 0.49 0.19 -0.12 0.00 0.22 0.00 0.00 39.33 40.11 2dno h ASP 86 CO 0.09 -0.29 -0.19 0.58 -1.72 0.00 0.00 179.24 177.71 2dno h VAL 87 N -0.44 0.32 0.13 -1.35 2.07 -1.39 1.06 116.25 116.64 2dno h VAL 87 Ca -0.03 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 2dno h VAL 87 Cb 0.38 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2dno h VAL 87 CO -0.01 0.00 -0.20 -0.09 0.02 0.00 0.00 177.57 177.29 2dno h ARG 88 N -0.03 -0.33 0.00 1.57 2.43 -0.94 0.70 114.38 117.77 2dno h ARG 88 Ca 0.30 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 2dno h ARG 88 Cb 0.49 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 2dno h ARG 88 CO -0.67 -0.22 0.00 -0.22 -1.51 0.00 0.00 179.97 177.35 2dno h LYS 89 N -0.35 0.00 0.00 0.20 3.64 -0.55 0.26 116.57 119.77 2dno h LYS 89 Ca -0.02 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 2dno h LYS 89 Cb 0.32 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 2dno h LYS 89 CO -0.06 0.00 -0.69 1.98 -2.27 0.00 0.00 179.45 178.41 2dno h MET 90 N 0.00 0.00 0.00 1.90 4.05 0.23 -3.31 114.93 117.80 2dno h MET 90 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2dno h MET 90 Cb 0.04 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 2dno h MET 90 CO 0.00 0.25 -1.17 1.19 0.23 0.00 0.00 176.91 177.41 2dno n PHE 91 N -3.02 0.00 -0.27 1.39 3.01 0.23 -4.40 117.46 114.40 2dno n PHE 91 Ca -0.01 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.41 2dno n PHE 91 Cb 0.68 -0.12 0.06 0.00 -0.01 0.00 0.00 39.48 40.09 2dno n PHE 91 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2dno h GLU 92 N 0.00 1.01 0.00 -1.08 5.08 -0.67 -2.21 114.58 116.71 2dno h GLU 92 Ca 0.00 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2dno h GLU 92 Cb 0.57 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2dno h GLU 92 CO 0.00 0.71 0.44 -2.30 -1.00 0.00 0.00 179.01 176.85 2dno n PRO 93 N -4.52 0.06 -0.77 2.33 -0.02 -1.26 0.12 135.00 130.95 2dno n PRO 93 Ca 0.07 0.51 0.01 0.00 -2.02 0.00 0.00 63.50 62.07 2dno n PRO 93 Cb 0.05 -2.13 0.19 0.00 -0.02 0.00 0.00 33.50 31.59 2dno n PRO 93 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2dno n PHE 94 N -1.89 0.45 0.00 6.00 3.72 -0.83 -5.05 117.46 119.86 2dno n PHE 94 Ca -0.01 -1.59 0.00 0.00 -0.05 0.00 0.00 57.45 55.80 2dno n PHE 94 Cb 0.45 -0.31 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 2dno n PHE 94 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dno n GLY 95 N -1.08 3.39 3.72 1.37 0.00 0.32 -4.38 105.19 108.53 2dno n GLY 95 Ca 0.24 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 2dno n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dno s THR 96 N -2.68 4.15 -0.21 2.61 2.01 -1.26 -4.01 115.64 116.25 2dno s THR 96 Ca 0.00 1.66 -0.14 0.00 0.31 0.00 0.00 61.69 63.53 2dno s THR 96 Cb 0.00 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.40 2dno s THR 96 CO 0.00 0.20 0.30 -0.63 -0.69 0.00 0.00 174.62 173.80 2dno s ILE 97 N 0.48 5.26 -0.18 1.82 1.01 -1.26 -0.12 121.20 128.21 2dno s ILE 97 Ca 0.53 0.51 -0.03 0.00 0.00 0.00 0.00 60.65 61.66 2dno s ILE 97 Cb -0.28 -3.64 -0.22 0.00 0.01 0.00 0.00 42.46 38.33 2dno s ILE 97 CO 0.31 0.29 0.13 -0.67 0.00 0.00 0.00 174.94 175.01 2dno n ASP 98 N 4.35 2.02 -4.24 3.58 2.03 -1.18 -4.92 116.55 118.21 2dno n ASP 98 Ca -0.11 0.07 -0.19 0.00 0.52 0.00 0.00 54.79 55.08 2dno n ASP 98 Cb 0.51 -0.65 -0.11 0.00 -0.72 0.00 0.00 41.12 40.15 2dno n ASP 98 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2dno s GLU 99 N -2.54 1.00 -0.30 -0.67 2.56 -1.26 -5.04 118.70 112.45 2dno s GLU 99 Ca -0.27 -1.17 -0.13 0.00 0.00 0.00 0.00 54.97 53.40 2dno s GLU 99 Cb 0.08 -0.97 0.17 0.00 2.00 0.00 0.00 34.13 35.40 2dno s GLU 99 CO 0.70 0.20 0.99 0.00 -0.56 0.00 0.00 175.26 176.59 2dno s THR 101 N 2.66 0.66 -0.22 0.00 2.01 -0.79 -4.97 115.64 114.98 2dno s THR 101 Ca 0.00 -0.29 -0.09 0.00 0.31 0.00 0.00 61.69 61.62 2dno s THR 101 Cb -0.08 -0.60 -0.04 0.00 0.01 0.00 0.00 72.50 71.79 2dno s THR 101 CO -0.15 0.21 0.12 -0.69 -0.69 0.00 0.00 174.62 173.41 2dno s VAL 102 N 0.24 5.06 -0.01 3.82 1.01 -1.26 -0.58 120.40 128.68 2dno s VAL 102 Ca -0.03 0.07 -0.27 0.00 0.00 0.00 0.00 61.98 61.74 2dno s VAL 102 Cb -0.08 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 2dno s VAL 102 CO 0.00 0.39 0.87 -0.76 0.00 0.00 0.00 175.10 175.60 2dno s LEU 103 N 0.83 4.37 0.15 3.92 1.43 -0.61 -4.99 118.68 123.78 2dno s LEU 103 Ca 0.06 1.50 -0.02 0.00 -1.03 0.00 0.00 54.13 54.64 2dno s LEU 103 Cb -0.13 -3.39 -0.03 0.00 0.03 0.00 0.00 46.19 42.67 2dno s LEU 103 CO 0.02 -0.18 0.11 -0.13 0.23 0.00 0.00 176.35 176.41 2dno s ARG 104 N 0.79 1.02 0.00 1.70 0.52 -1.26 -2.97 118.95 118.74 2dno s ARG 104 Ca 0.46 -1.43 0.00 0.00 -0.52 0.00 0.00 55.73 54.24 2dno s ARG 104 Cb -0.20 0.27 0.00 0.00 0.52 0.00 0.00 34.95 35.54 2dno s ARG 104 CO 0.25 -0.31 0.00 0.41 0.02 0.00 0.00 175.30 175.66 2dno n GLY 105 N -0.14 5.15 3.26 -3.53 0.00 -0.26 -4.85 105.19 104.81 2dno n GLY 105 Ca -0.04 -1.65 -0.36 0.00 0.00 0.00 0.00 46.02 43.96 2dno n GLY 105 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dno n PRO 106 N 0.00 0.05 -4.24 1.61 -0.02 -1.26 -2.20 135.00 128.95 2dno n PRO 106 Ca 0.00 0.04 -0.36 0.00 -2.02 0.00 0.00 63.50 61.16 2dno n PRO 106 Cb 0.00 -1.37 -0.03 0.00 -0.02 0.00 0.00 33.50 32.08 2dno n PRO 106 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2dno n ASP 107 N 1.45 -2.93 -3.96 2.55 9.92 -1.26 -0.95 116.55 121.37 2dno n ASP 107 Ca 0.05 -1.03 -0.34 0.00 -0.53 0.00 0.00 54.79 52.94 2dno n ASP 107 Cb 0.52 -2.67 -0.07 0.00 -0.64 0.00 0.00 41.12 38.26 2dno n ASP 107 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dno n GLY 108 N -1.43 -0.30 3.73 0.44 0.00 -0.93 -4.86 105.19 101.84 2dno n GLY 108 Ca 0.05 0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 2dno n GLY 108 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dno s THR 109 N -2.95 5.21 -0.24 2.61 2.01 -0.13 -4.87 115.64 117.28 2dno s THR 109 Ca 0.60 0.85 -0.29 0.00 0.31 0.00 0.00 61.69 63.17 2dno s THR 109 Cb -0.35 -3.77 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 2dno s THR 109 CO 0.83 0.35 1.90 -0.55 -0.69 0.00 0.00 174.62 176.45 2dno s SER 110 N 0.56 5.91 0.65 3.53 0.15 -1.26 -1.10 113.70 122.13 2dno s SER 110 Ca 0.24 1.65 0.40 0.00 0.70 0.00 0.00 55.95 58.94 2dno s SER 110 Cb -0.15 -2.52 2.22 0.00 -1.71 0.00 0.00 66.02 63.86 2dno s SER 110 CO 0.09 -1.64 2.31 0.11 1.20 0.00 0.00 173.24 175.31 2dno h LYS 111 N 12.89 0.00 0.00 5.44 1.57 -1.86 -3.43 116.57 131.18 2dno h LYS 111 Ca -0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 2dno h LYS 111 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2dno h LYS 111 CO 1.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 180.29 2dno n GLY 112 N -1.16 1.04 3.55 3.86 0.00 -1.26 -4.94 105.19 106.28 2dno n GLY 112 Ca -0.03 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 2dno n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dno s ALA 114 N -1.10 -1.61 -0.16 0.00 0.00 -0.81 -1.58 121.76 116.50 2dno s ALA 114 Ca -0.07 0.87 -0.07 0.00 0.00 0.00 0.00 51.96 52.69 2dno s ALA 114 Cb -0.00 0.39 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 2dno s ALA 114 CO 0.06 -0.54 0.09 -0.06 0.00 0.00 0.00 175.76 175.31 2dno s PHE 115 N -2.34 3.35 -0.12 0.00 0.08 0.25 -0.85 117.98 118.35 2dno s PHE 115 Ca -0.06 0.24 0.02 0.00 0.12 0.00 0.00 56.93 57.25 2dno s PHE 115 Cb -0.01 -2.03 0.02 0.00 -0.57 0.00 0.00 43.02 40.43 2dno s PHE 115 CO -0.00 0.34 -0.16 0.08 -0.10 0.00 0.00 175.22 175.38 2dno s VAL 116 N -0.08 1.57 0.01 -0.44 1.01 -0.55 -1.88 120.40 120.04 2dno s VAL 116 Ca 0.08 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.39 2dno s VAL 116 Cb -0.12 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2dno s VAL 116 CO 0.01 0.46 0.03 -0.75 0.00 0.00 0.00 175.10 174.84 2dno s LYS 117 N 1.03 2.87 0.11 2.72 2.20 -0.38 -0.36 119.74 127.94 2dno s LYS 117 Ca -0.05 -0.58 0.09 0.00 -0.36 0.00 0.00 55.97 55.06 2dno s LYS 117 Cb -0.15 -2.73 -0.04 0.00 -1.51 0.00 0.00 37.83 33.41 2dno s LYS 117 CO -0.03 0.63 -0.17 -0.06 -0.36 0.00 0.00 175.35 175.36 2dno s PHE 118 N -1.15 2.56 0.51 4.03 0.40 -1.26 -3.09 117.98 119.99 2dno s PHE 118 Ca 0.21 -0.25 0.30 0.00 -0.60 0.00 0.00 56.93 56.60 2dno s PHE 118 Cb -0.12 -1.36 1.42 0.00 0.51 0.00 0.00 43.02 43.47 2dno s PHE 118 CO 0.12 0.38 1.84 0.37 0.70 0.00 0.00 175.22 178.64 2dno h GLN 119 N 3.76 0.09 -2.64 0.44 5.75 -0.88 -3.41 115.11 118.22 2dno h GLN 119 Ca -0.50 -0.01 -0.11 0.00 -0.15 0.00 0.00 58.65 57.89 2dno h GLN 119 Cb 1.17 -0.02 -0.23 0.00 1.07 0.00 0.00 27.48 29.47 2dno h GLN 119 CO 0.47 0.06 -0.17 0.95 -2.65 0.00 0.00 178.83 177.49 2dno s THR 120 N -5.08 0.01 0.25 2.39 -4.23 -1.26 -5.05 115.64 102.67 2dno s THR 120 Ca -0.06 -0.07 -0.12 0.00 -1.18 0.00 0.00 61.69 60.26 2dno s THR 120 Cb 0.23 -0.66 0.34 0.00 1.34 0.00 0.00 72.50 73.74 2dno s THR 120 CO 0.79 -0.04 1.58 -0.74 -0.54 0.00 0.00 174.62 175.67 2dno h HIS 121 N 5.02 -0.60 -0.64 3.99 -0.00 -1.91 -1.25 115.15 119.74 2dno h HIS 121 Ca -0.28 0.08 0.06 0.00 -0.00 0.00 0.00 60.37 60.23 2dno h HIS 121 Cb 1.18 0.40 -0.08 0.00 -0.00 0.00 0.00 27.41 28.91 2dno h HIS 121 CO 0.42 -0.38 -0.38 0.00 -0.00 0.00 0.00 177.93 177.58 2dno n ALA 122 N -3.42 -0.41 -0.03 5.26 0.00 -1.26 -1.00 120.51 119.65 2dno n ALA 122 Ca 0.12 0.55 -0.14 0.00 0.00 0.00 0.00 53.44 53.97 2dno n ALA 122 Cb 0.43 0.04 -0.09 0.00 0.00 0.00 0.00 19.45 19.83 2dno n ALA 122 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2dno h GLU 123 N 0.00 -0.51 -0.84 0.00 4.39 -1.50 -1.94 114.58 114.18 2dno h GLU 123 Ca 0.10 0.03 0.13 0.00 0.34 0.00 0.00 59.36 59.96 2dno h GLU 123 Cb 0.26 0.12 -0.13 0.00 -0.10 0.00 0.00 28.75 28.90 2dno h GLU 123 CO -0.61 -0.34 -0.34 0.00 -1.16 0.00 0.00 179.01 176.56 2dno n ALA 124 N -3.00 -0.14 -0.02 3.43 0.00 -0.17 -0.18 120.51 120.42 2dno n ALA 124 Ca -0.05 0.83 -0.13 0.00 0.00 0.00 0.00 53.44 54.09 2dno n ALA 124 Cb 0.37 -0.35 -0.07 0.00 0.00 0.00 0.00 19.45 19.40 2dno n ALA 124 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2dno h GLN 125 N 0.00 -0.48 -0.59 0.00 5.75 -0.67 -2.62 115.11 116.50 2dno h GLN 125 Ca 0.28 0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.87 2dno h GLN 125 Cb 0.49 0.11 -0.07 0.00 1.07 0.00 0.00 27.48 29.08 2dno h GLN 125 CO -0.83 -0.32 -0.35 0.00 -2.65 0.00 0.00 178.83 174.68 2dno n ALA 126 N -2.98 -0.38 -0.19 3.38 0.00 0.74 -1.58 120.51 119.50 2dno n ALA 126 Ca -0.04 0.50 -0.07 0.00 0.00 0.00 0.00 53.44 53.83 2dno n ALA 126 Cb 0.37 0.11 -0.06 0.00 0.00 0.00 0.00 19.45 19.87 2dno n ALA 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dno h ALA 127 N -0.09 -0.38 -0.53 0.00 0.00 -1.22 -2.01 119.26 115.02 2dno h ALA 127 Ca 0.09 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.10 2dno h ALA 127 Cb 0.24 1.14 -0.07 0.00 0.00 0.00 0.00 17.79 19.11 2dno h ALA 127 CO -0.56 -0.60 -0.33 0.82 0.00 0.00 0.00 179.25 178.59 2dno h ILE 128 N -0.06 0.00 -0.81 0.00 2.04 -1.00 2.00 117.51 119.67 2dno h ILE 128 Ca 0.08 0.00 0.32 0.00 1.00 0.00 0.00 64.86 66.25 2dno h ILE 128 Cb 0.26 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.22 2dno h ILE 128 CO -0.48 0.00 0.47 -3.20 0.00 0.00 0.00 178.15 174.94 2dno n ASN 129 N -4.26 0.22 0.00 1.72 2.85 -0.74 0.46 115.26 115.51 2dno n ASN 129 Ca 0.01 1.14 0.00 0.00 -0.11 0.00 0.00 54.58 55.62 2dno n ASN 129 Cb 0.15 -0.56 0.00 0.00 1.24 0.00 0.00 39.78 40.61 2dno n ASN 129 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 2dno n THR 130 N -4.49 0.00 -0.33 -0.44 -1.04 0.17 -4.64 114.28 103.51 2dno n THR 130 Ca 0.28 0.37 0.15 0.00 -2.04 0.00 0.00 64.05 62.81 2dno n THR 130 Cb 1.00 -1.36 0.29 0.00 -1.82 0.00 0.00 70.33 68.44 2dno n THR 130 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2dno n LEU 131 N -2.33 -0.10 -4.64 -4.42 4.77 0.63 -3.94 117.00 106.97 2dno n LEU 131 Ca 0.00 1.62 -0.59 0.00 -0.03 0.00 0.00 56.01 57.01 2dno n LEU 131 Cb 0.00 -0.60 -0.08 0.00 -2.33 0.00 0.00 43.42 40.41 2dno n LEU 131 CO 0.00 -1.64 1.39 1.57 -1.33 0.00 0.00 177.39 177.38 2dno n HIS 132 N -5.41 1.85 -4.03 -1.77 -0.00 0.17 -0.79 115.22 105.26 2dno n HIS 132 Ca 0.23 0.65 -0.31 0.00 0.46 0.00 0.00 57.72 58.75 2dno n HIS 132 Cb 0.75 -2.41 -0.03 0.00 -0.12 0.00 0.00 29.99 28.19 2dno n HIS 132 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2dno n SER 133 N 5.89 -1.32 0.00 0.26 2.88 0.20 -4.92 113.62 116.61 2dno n SER 133 Ca 0.32 -1.13 0.00 0.00 -1.33 0.00 0.00 58.87 56.74 2dno n SER 133 Cb 0.08 -2.51 0.00 0.00 -0.75 0.00 0.00 64.21 61.03 2dno n SER 133 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dno n SER 134 N -2.79 0.00 -5.01 -3.46 3.41 0.03 -4.89 113.62 100.91 2dno n SER 134 Ca -0.25 0.05 -0.18 0.00 -0.26 0.00 0.00 58.87 58.23 2dno n SER 134 Cb 0.66 -0.33 0.02 0.00 -0.26 0.00 0.00 64.21 64.30 2dno n SER 134 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dno s ARG 135 N -0.65 2.69 -0.52 4.33 1.70 -1.26 -4.91 118.95 120.32 2dno s ARG 135 Ca 0.00 -1.30 0.03 0.00 -0.47 0.00 0.00 55.73 54.00 2dno s ARG 135 Cb 0.00 -2.71 0.14 0.00 -0.57 0.00 0.00 34.95 31.81 2dno s ARG 135 CO 0.00 -0.44 0.30 0.99 -1.08 0.00 0.00 175.30 175.08 2dno s THR 136 N -2.45 2.01 0.70 4.99 2.01 -1.26 -0.82 115.64 120.82 2dno s THR 136 Ca 0.57 -3.16 -0.17 0.00 0.31 0.00 0.00 61.69 59.25 2dno s THR 136 Cb -0.09 -2.38 -0.07 0.00 0.01 0.00 0.00 72.50 69.97 2dno s THR 136 CO 0.35 -0.91 0.33 0.18 -0.69 0.00 0.00 174.62 173.88 2dno n LEU 137 N 3.04 -0.35 -4.69 4.42 4.77 -1.26 -4.87 117.00 118.06 2dno n LEU 137 Ca 0.11 0.58 -0.42 0.00 -0.03 0.00 0.00 56.01 56.25 2dno n LEU 137 Cb 0.35 -1.12 -0.03 0.00 -2.33 0.00 0.00 43.42 40.29 2dno n LEU 137 CO 0.27 -3.58 1.08 -2.16 -1.33 0.00 0.00 177.39 171.67 2dno s PRO 138 N -2.40 4.30 0.00 3.23 0.04 -1.26 -2.95 135.00 135.96 2dno s PRO 138 Ca 0.62 1.90 0.00 0.00 0.04 0.00 0.00 61.00 63.56 2dno s PRO 138 Cb -0.36 -3.56 0.00 0.00 0.04 0.00 0.00 34.50 30.61 2dno s PRO 138 CO 0.61 -0.54 0.00 0.41 0.04 0.00 0.00 177.00 177.52 2dno n GLY 139 N 3.58 0.70 3.02 0.56 0.00 -1.26 -4.82 105.19 106.97 2dno n GLY 139 Ca 0.13 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.37 2dno n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dno s ALA 140 N -2.00 2.25 0.00 4.61 0.00 -1.15 -4.98 121.76 120.49 2dno s ALA 140 Ca 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 51.96 50.49 2dno s ALA 140 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.69 2dno s ALA 140 CO 0.00 -1.02 0.44 0.43 0.00 0.00 0.00 175.76 175.61 2dno n SER 141 N 4.57 0.00 -3.85 0.00 7.64 -1.26 -4.59 113.62 116.14 2dno n SER 141 Ca -0.14 0.44 -0.16 0.00 1.01 0.00 0.00 58.87 60.02 2dno n SER 141 Cb 0.44 -0.12 0.08 0.00 -1.01 0.00 0.00 64.21 63.60 2dno n SER 141 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dno n SER 142 N -1.52 1.03 -4.40 6.43 3.41 -1.26 -5.09 113.62 112.22 2dno n SER 142 Ca 0.00 -1.85 -0.29 0.00 -0.26 0.00 0.00 58.87 56.47 2dno n SER 142 Cb 0.00 -0.44 0.16 0.00 -0.26 0.00 0.00 64.21 63.67 2dno n SER 142 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dno s SER 143 N -3.86 3.09 -0.06 4.04 0.01 -1.26 -4.71 113.70 110.95 2dno s SER 143 Ca 0.47 0.62 -0.34 0.00 1.31 0.00 0.00 55.95 58.01 2dno s SER 143 Cb -0.03 -0.93 -0.12 0.00 0.21 0.00 0.00 66.02 65.15 2dno s SER 143 CO 0.31 -2.78 1.85 -0.11 0.41 0.00 0.00 173.24 172.92 2dno n LEU 144 N -3.86 3.40 -4.37 2.44 7.94 0.00 -4.76 117.00 117.79 2dno n LEU 144 Ca 0.11 0.99 -0.45 0.00 -1.11 0.00 0.00 56.01 55.55 2dno n LEU 144 Cb 0.60 -1.37 -0.06 0.00 0.53 0.00 0.00 43.42 43.11 2dno n LEU 144 CO 0.51 -0.09 0.18 -0.69 -1.11 0.00 0.00 177.39 176.19 2dno s VAL 145 N 3.72 5.10 -0.20 1.96 1.01 -0.88 0.60 120.40 131.71 2dno s VAL 145 Ca 0.91 -1.11 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 2dno s VAL 145 Cb -0.70 -4.28 -0.01 0.00 0.00 0.00 0.00 36.38 31.39 2dno s VAL 145 CO 0.50 -0.80 -0.07 -0.69 0.00 0.00 0.00 175.10 174.04 2dno s VAL 146 N 1.95 3.27 0.14 2.92 1.01 -1.26 0.54 120.40 128.98 2dno s VAL 146 Ca 0.07 -0.54 -0.14 0.00 0.00 0.00 0.00 61.98 61.37 2dno s VAL 146 Cb -0.25 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.69 2dno s VAL 146 CO 0.06 0.45 0.37 -1.59 0.00 0.00 0.00 175.10 174.40 2dno s LYS 147 N 1.18 1.11 0.44 2.72 -2.85 -0.68 -4.62 119.74 117.05 2dno s LYS 147 Ca 0.02 -0.86 -0.26 0.00 -1.00 0.00 0.00 55.97 53.88 2dno s LYS 147 Cb -0.14 0.44 -0.09 0.00 -2.06 0.00 0.00 37.83 35.98 2dno s LYS 147 CO -0.02 -0.43 1.44 -0.06 0.10 0.00 0.00 175.35 176.38 2dno s PHE 148 N -3.85 2.45 0.07 1.78 0.08 -1.26 0.53 117.98 117.79 2dno s PHE 148 Ca 0.07 1.24 -0.20 0.00 0.12 0.00 0.00 56.93 58.16 2dno s PHE 148 Cb 0.02 -3.95 -0.07 0.00 -0.57 0.00 0.00 43.02 38.46 2dno s PHE 148 CO -0.08 -2.99 0.61 0.00 -0.10 0.00 0.00 175.22 172.66 2dno s ALA 149 N -1.19 3.55 -0.20 5.36 0.00 -1.19 -4.41 121.76 123.68 2dno s ALA 149 Ca 0.60 0.09 -0.23 0.00 0.00 0.00 0.00 51.96 52.42 2dno s ALA 149 Cb -0.44 -2.71 0.06 0.00 0.00 0.00 0.00 23.12 20.03 2dno s ALA 149 CO 0.57 0.34 0.63 0.34 0.00 0.00 0.00 175.76 177.65 2dno s ASP 150 N -0.96 -0.64 -0.27 0.00 2.15 -1.26 -4.88 116.67 110.82 2dno s ASP 150 Ca 0.30 1.14 -0.09 0.00 0.43 0.00 0.00 52.55 54.33 2dno s ASP 150 Cb -0.20 1.13 -0.04 0.00 -0.30 0.00 0.00 42.92 43.52 2dno s ASP 150 CO 0.20 -0.29 0.13 0.28 -0.17 0.00 0.00 175.17 175.32 2dno s THR 151 N 0.02 4.77 0.92 1.71 -1.32 -1.26 -5.09 115.64 115.39 2dno s THR 151 Ca -0.02 -0.04 -0.15 0.00 -1.21 0.00 0.00 61.69 60.27 2dno s THR 151 Cb -0.04 -3.27 0.16 0.00 -1.51 0.00 0.00 72.50 67.85 2dno s THR 151 CO 0.02 0.28 1.25 -1.61 -2.21 0.00 0.00 174.62 172.35 2dno s GLU 152 N 1.68 0.98 0.45 7.08 8.01 -1.26 -5.09 118.70 130.55 2dno s GLU 152 Ca 0.07 -0.16 0.08 0.00 0.01 0.00 0.00 54.97 54.96 2dno s GLU 152 Cb -0.16 -1.86 0.00 0.00 -4.31 0.00 0.00 34.13 27.81 2dno s GLU 152 CO 0.07 -2.22 0.47 -1.59 0.01 0.00 0.00 175.26 172.00 2dno s LYS 153 N -5.71 2.54 -0.07 1.61 -2.85 -1.26 -5.12 119.74 108.87 2dno s LYS 153 Ca 0.69 -1.54 -0.01 0.00 -1.00 0.00 0.00 55.97 54.10 2dno s LYS 153 Cb -0.07 -2.45 -0.03 0.00 -2.06 0.00 0.00 37.83 33.21 2dno s LYS 153 CO 0.52 -0.33 0.01 -2.00 0.10 0.00 0.00 175.35 173.64 2dno s GLU 154 N -4.25 2.96 -0.14 1.78 2.12 -1.26 -5.10 118.70 114.80 2dno s GLU 154 Ca 0.49 -0.43 -0.02 0.00 0.36 0.00 0.00 54.97 55.38 2dno s GLU 154 Cb -0.05 -2.78 0.04 0.00 0.26 0.00 0.00 34.13 31.60 2dno s GLU 154 CO 0.29 0.69 -0.01 -1.54 -0.54 0.00 0.00 175.26 174.16 2dno s SER 155 N -0.99 2.45 -0.40 -1.70 1.04 -1.26 -5.09 113.70 107.75 2dno s SER 155 Ca 0.14 -0.52 0.01 0.00 0.48 0.00 0.00 55.95 56.06 2dno s SER 155 Cb -0.11 -0.66 0.13 0.00 0.10 0.00 0.00 66.02 65.48 2dno s SER 155 CO 0.04 -0.22 0.22 -0.83 0.98 0.00 0.00 173.24 173.42 2dno s GLY 156 N 1.81 1.32 0.00 7.32 0.00 -1.26 -4.96 107.32 111.56 2dno s GLY 156 Ca 0.02 -2.25 0.00 0.00 0.00 0.00 0.00 44.72 42.49 2dno s GLY 156 CO -0.07 1.75 0.72 -1.55 0.00 0.00 0.00 173.10 173.95 2dno n PRO 157 N 3.83 0.86 -0.11 2.90 -0.04 -1.26 -4.12 135.00 137.06 2dno n PRO 157 Ca 0.09 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.50 2dno n PRO 157 Cb 0.36 -1.13 0.01 0.00 -0.04 0.00 0.00 33.50 32.69 2dno n PRO 157 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dno h SER 158 N 0.04 -0.42 0.00 3.54 0.87 -2.06 -3.38 113.55 112.14 2dno h SER 158 Ca 0.00 0.12 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2dno h SER 158 Cb 0.13 0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2dno h SER 158 CO 0.00 -0.15 -0.41 -1.20 -0.53 0.00 0.00 176.83 174.54 2dno n SER 159 N -5.31 0.68 0.00 6.23 7.64 -1.26 -5.36 113.62 116.25 2dno n SER 159 Ca 0.02 0.09 0.00 0.00 1.01 0.00 0.00 58.87 59.98 2dno n SER 159 Cb 0.23 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 2dno n SER 159 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64