#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dno n SER 60 N 0.00 -3.15 -4.29 1.61 7.64 -1.26 -4.95 113.62 109.23 2dno n SER 60 Ca 0.00 -0.93 -0.33 0.00 1.01 0.00 0.00 58.87 58.61 2dno n SER 60 Cb 0.00 -3.21 -0.15 0.00 -1.01 0.00 0.00 64.21 59.84 2dno n SER 60 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dno s SER 61 N -3.54 3.82 -0.00 6.43 0.01 -1.26 -5.11 113.70 114.06 2dno s SER 61 Ca 0.56 -0.43 -0.03 0.00 1.31 0.00 0.00 55.95 57.35 2dno s SER 61 Cb -0.29 -1.60 -0.00 0.00 0.21 0.00 0.00 66.02 64.33 2dno s SER 61 CO 0.89 0.08 0.06 -0.83 0.41 0.00 0.00 173.24 173.85 2dno s GLY 62 N 0.84 0.08 -0.04 3.44 0.00 -1.26 -5.15 107.32 105.22 2dno s GLY 62 Ca -0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 44.72 44.50 2dno s GLY 62 CO 0.00 -0.26 0.02 -0.45 0.00 0.00 0.00 173.10 172.42 2dno s SER 63 N -0.96 0.87 0.39 1.64 0.15 -1.26 -5.15 113.70 109.38 2dno s SER 63 Ca -0.10 -0.00 0.04 0.00 0.70 0.00 0.00 55.95 56.58 2dno s SER 63 Cb -0.06 -0.24 -0.05 0.00 -1.71 0.00 0.00 66.02 63.96 2dno s SER 63 CO 0.00 -0.17 0.06 -0.44 1.20 0.00 0.00 173.24 173.90 2dno s SER 64 N 1.57 3.00 0.00 5.45 0.01 -1.26 -5.05 113.70 117.43 2dno s SER 64 Ca -0.02 -1.50 0.00 0.00 1.31 0.00 0.00 55.95 55.74 2dno s SER 64 Cb -0.13 0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.22 2dno s SER 64 CO -0.03 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 173.53 2dno n GLY 65 N -0.88 0.74 3.62 3.44 0.00 -1.26 -5.08 105.19 105.76 2dno n GLY 65 Ca -0.06 -0.63 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 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 0.00 6.45 -0.42 1.61 0.01 -1.26 -5.03 113.70 115.07 2dno s SER 66 Ca 0.00 0.54 -0.29 0.00 1.31 0.00 0.00 55.95 57.51 2dno s SER 66 Cb 0.00 -2.29 0.02 0.00 0.21 0.00 0.00 66.02 63.96 2dno s SER 66 CO 0.00 -0.30 1.28 -0.60 0.41 0.00 0.00 173.24 174.03 2dno s ARG 67 N 2.34 3.69 0.00 12.44 3.52 -1.26 -4.67 118.95 135.02 2dno s ARG 67 Ca 0.22 0.85 0.00 0.00 -0.13 0.00 0.00 55.73 56.67 2dno s ARG 67 Cb -0.16 -3.95 0.00 0.00 -1.56 0.00 0.00 34.95 29.28 2dno s ARG 67 CO 0.09 -1.41 0.00 0.41 -0.81 0.00 0.00 175.30 173.58 2dno n GLY 68 N 4.84 -1.74 3.53 8.12 0.00 -1.26 -4.97 105.19 113.71 2dno n GLY 68 Ca 0.14 0.57 -0.41 0.00 0.00 0.00 0.00 46.02 46.32 2dno n GLY 68 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dno s GLU 69 N 0.00 3.21 -0.29 1.61 0.41 -1.26 -4.72 118.70 117.65 2dno s GLU 69 Ca 0.00 -0.42 -0.16 0.00 -0.41 0.00 0.00 54.97 53.98 2dno s GLU 69 Cb 0.00 -4.28 0.17 0.00 -1.78 0.00 0.00 34.13 28.24 2dno s GLU 69 CO 0.00 -2.09 1.07 0.34 -0.49 0.00 0.00 175.26 174.09 2dno s ASP 70 N 3.81 -0.37 0.22 -0.19 -1.08 -1.26 -5.05 116.67 112.76 2dno s ASP 70 Ca 0.34 0.57 -0.15 0.00 -0.52 0.00 0.00 52.55 52.79 2dno s ASP 70 Cb -0.09 1.20 0.26 0.00 -1.46 0.00 0.00 42.92 42.84 2dno s ASP 70 CO 0.12 -0.09 1.59 0.03 0.52 0.00 0.00 175.17 177.34 2dno h ARG 71 N 6.03 -0.04 -6.23 4.34 3.08 -1.91 -3.40 114.38 116.24 2dno h ARG 71 Ca -0.25 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.13 2dno h ARG 71 Cb 1.17 0.01 0.02 0.00 0.08 0.00 0.00 29.97 31.25 2dno h ARG 71 CO 0.19 -0.03 0.95 1.17 -1.07 0.00 0.00 179.97 181.18 2dno n LYS 72 N -5.49 1.65 -4.64 0.04 4.81 -1.26 -4.18 118.16 109.09 2dno n LYS 72 Ca 0.09 0.61 -0.34 0.00 -0.87 0.00 0.00 58.31 57.80 2dno n LYS 72 Cb 0.39 -2.36 -0.12 0.00 0.02 0.00 0.00 35.03 32.96 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 3.40 3.12 -0.38 3.14 1.43 0.30 -2.02 118.68 127.68 2dno s LEU 73 Ca 0.94 -0.05 -0.18 0.00 -1.03 0.00 0.00 54.13 53.80 2dno s LEU 73 Cb -0.88 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 43.67 2dno s LEU 73 CO 0.57 0.34 0.51 0.12 0.23 0.00 0.00 176.35 178.13 2dno s PHE 74 N -0.70 3.16 -0.11 0.29 2.19 0.26 -1.87 117.98 121.19 2dno s PHE 74 Ca 0.11 0.03 -0.04 0.00 0.33 0.00 0.00 56.93 57.36 2dno s PHE 74 Cb -0.11 -2.98 -0.04 0.00 -1.31 0.00 0.00 43.02 38.58 2dno s PHE 74 CO 0.02 -0.62 0.06 0.08 1.83 0.00 0.00 175.22 176.58 2dno s VAL 75 N 2.40 4.78 0.00 3.12 1.01 -0.71 -1.84 120.40 129.16 2dno s VAL 75 Ca 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.09 2dno s VAL 75 Cb -0.16 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.17 2dno s VAL 75 CO 0.14 0.59 0.00 0.61 0.00 0.00 0.00 175.10 176.44 2dno n GLY 76 N 2.29 4.25 3.56 4.51 0.00 0.37 -1.72 105.19 118.45 2dno n GLY 76 Ca -0.19 -1.81 -0.26 0.00 0.00 0.00 0.00 46.02 43.76 2dno n GLY 76 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dno n MET 77 N 0.00 -4.78 -3.28 1.61 2.81 -1.04 -3.40 117.12 109.05 2dno n MET 77 Ca 0.00 0.62 -0.25 0.00 -1.81 0.00 0.00 57.70 56.26 2dno n MET 77 Cb 0.00 -5.46 -0.01 0.00 -0.71 0.00 0.00 33.22 27.04 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 -6.92 3.98 0.19 4.03 1.43 -1.05 -4.74 118.68 115.60 2dno s LEU 78 Ca 0.51 0.57 0.08 0.00 -1.03 0.00 0.00 54.13 54.25 2dno s LEU 78 Cb -0.26 -3.43 -0.04 0.00 0.03 0.00 0.00 46.19 42.50 2dno s LEU 78 CO 0.63 -0.30 -0.01 -0.83 0.23 0.00 0.00 176.35 176.07 2dno s GLY 79 N -3.84 1.71 0.19 -3.19 0.00 -1.26 -4.49 107.32 96.45 2dno s GLY 79 Ca 0.42 -1.42 -0.12 0.00 0.00 0.00 0.00 44.72 43.61 2dno s GLY 79 CO 0.36 -1.44 1.77 0.50 0.00 0.00 0.00 173.10 174.29 2dno h LYS 80 N 2.62 0.47 -0.16 2.90 1.57 -1.94 -2.98 116.57 119.04 2dno h LYS 80 Ca -0.47 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.31 2dno h LYS 80 Cb 1.21 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.37 2dno h LYS 80 CO 0.58 0.31 -0.33 0.37 -0.57 0.00 0.00 179.45 179.80 2dno h GLN 81 N 0.48 -0.29 -6.31 3.15 5.75 -1.96 -3.42 115.11 112.52 2dno h GLN 81 Ca 0.26 0.02 -0.58 0.00 -0.15 0.00 0.00 58.65 58.19 2dno h GLN 81 Cb 0.22 0.07 0.18 0.00 1.07 0.00 0.00 27.48 29.02 2dno h GLN 81 CO -0.21 -0.19 -0.75 1.04 -2.65 0.00 0.00 178.83 176.07 2dno n GLN 82 N -4.30 0.26 -4.43 1.69 1.13 -1.13 -5.01 117.38 105.59 2dno n GLN 82 Ca -0.03 0.11 -0.23 0.00 -1.94 0.00 0.00 57.00 54.91 2dno n GLN 82 Cb 0.22 -1.42 -0.08 0.00 0.11 0.00 0.00 30.24 29.06 2dno n GLN 82 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2dno s THR 83 N -1.86 0.48 0.40 5.09 -4.23 -1.26 -4.89 115.64 109.35 2dno s THR 83 Ca 0.62 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.27 2dno s THR 83 Cb -0.44 -2.43 0.35 0.00 1.34 0.00 0.00 72.50 71.32 2dno s THR 83 CO 0.61 0.00 1.88 0.44 -0.54 0.00 0.00 174.62 177.00 2dno h ASP 84 N 1.96 0.50 -0.49 3.99 5.19 -1.95 -0.55 116.42 125.06 2dno h ASP 84 Ca -0.34 0.04 -0.05 0.00 -0.62 0.00 0.00 57.03 56.06 2dno h ASP 84 Cb 1.26 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 40.69 2dno h ASP 84 CO 0.53 0.24 0.11 -0.08 -3.12 0.00 0.00 179.24 176.92 2dno h GLU 85 N 0.52 0.79 0.00 3.56 4.81 -1.97 -2.26 114.58 120.04 2dno h GLU 85 Ca 0.43 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.47 2dno h GLU 85 Cb 0.90 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.18 2dno h GLU 85 CO -0.18 0.77 0.00 -0.25 -0.73 0.00 0.00 179.01 178.63 2dno n ASP 86 N -4.46 0.00 -0.34 1.04 8.00 -0.24 -0.91 116.55 119.65 2dno n ASP 86 Ca 0.01 0.77 0.09 0.00 0.71 0.00 0.00 54.79 56.36 2dno n ASP 86 Cb 0.23 -0.27 0.19 0.00 -0.02 0.00 0.00 41.12 41.25 2dno n ASP 86 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2dno h VAL 87 N 0.00 0.05 0.08 2.53 2.07 -1.61 0.74 116.25 120.11 2dno h VAL 87 Ca 0.00 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2dno h VAL 87 Cb 0.00 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 29.81 2dno h VAL 87 CO 0.00 0.00 -0.08 -0.09 0.02 0.00 0.00 177.57 177.42 2dno h ARG 88 N 0.01 -0.16 -0.04 1.57 2.43 -1.36 0.67 114.38 117.50 2dno h ARG 88 Ca 0.51 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.70 2dno h ARG 88 Cb 0.90 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.48 2dno h ARG 88 CO -0.94 -0.10 0.15 -0.22 -1.51 0.00 0.00 179.97 177.34 2dno h LYS 89 N -0.16 0.00 0.00 0.20 3.64 -0.07 0.38 116.57 120.56 2dno h LYS 89 Ca -0.01 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 2dno h LYS 89 Cb 0.14 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 2dno h LYS 89 CO -0.01 0.00 -0.64 1.98 -2.27 0.00 0.00 179.45 178.50 2dno h MET 90 N 0.00 0.00 -0.00 1.90 4.05 0.13 -3.29 114.93 117.71 2dno h MET 90 Ca 0.02 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.44 2dno h MET 90 Cb 0.31 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.11 2dno h MET 90 CO -0.00 0.25 -0.77 1.19 0.23 0.00 0.00 176.91 177.81 2dno n PHE 91 N -3.03 0.00 -0.20 1.39 3.01 0.23 -4.40 117.46 114.46 2dno n PHE 91 Ca -0.00 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.37 2dno n PHE 91 Cb 0.67 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 40.16 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 0.54 0.89 0.00 -1.08 5.08 -0.52 -2.70 114.58 116.79 2dno h GLU 92 Ca 0.00 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 2dno h GLU 92 Cb 0.50 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2dno h GLU 92 CO 0.00 0.85 0.44 -2.30 -1.00 0.00 0.00 179.01 176.99 2dno n PRO 93 N -4.39 0.06 -0.79 2.33 -0.02 -1.26 0.12 135.00 131.05 2dno n PRO 93 Ca 0.02 0.51 0.01 0.00 -2.02 0.00 0.00 63.50 62.02 2dno n PRO 93 Cb 0.24 -2.13 0.19 0.00 -0.02 0.00 0.00 33.50 31.78 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 0.51 0.00 6.00 3.72 -1.02 -5.06 117.46 119.72 2dno n PHE 94 Ca -0.01 -1.61 0.00 0.00 -0.05 0.00 0.00 57.45 55.79 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 3.07 3.74 1.37 0.00 0.32 -4.50 105.19 108.12 2dno n GLY 95 Ca 0.25 -1.96 -0.40 0.00 0.00 0.00 0.00 46.02 43.90 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 -2.27 4.55 -0.27 2.61 2.01 -1.26 -4.03 115.64 116.98 2dno s THR 96 Ca 0.00 1.84 -0.14 0.00 0.31 0.00 0.00 61.69 63.70 2dno s THR 96 Cb 0.00 -4.21 -0.04 0.00 0.01 0.00 0.00 72.50 68.26 2dno s THR 96 CO 0.00 0.37 0.35 -0.63 -0.69 0.00 0.00 174.62 174.03 2dno s ILE 97 N -0.24 5.19 -0.08 1.82 1.01 -1.26 -0.26 121.20 127.37 2dno s ILE 97 Ca 0.42 0.52 -0.17 0.00 0.00 0.00 0.00 60.65 61.42 2dno s ILE 97 Cb -0.22 -3.68 -0.29 0.00 0.01 0.00 0.00 42.46 38.28 2dno s ILE 97 CO 0.27 0.16 0.65 -0.78 0.00 0.00 0.00 174.94 175.24 2dno h ASP 98 N 8.20 0.43 -3.87 3.58 3.58 -1.38 -3.48 116.42 123.49 2dno h ASP 98 Ca -0.32 -0.88 -0.28 0.00 0.42 0.00 0.00 57.03 55.97 2dno h ASP 98 Cb 1.16 -0.14 -0.28 0.00 1.72 0.00 0.00 39.33 41.80 2dno h ASP 98 CO 0.63 1.58 -0.74 -1.61 -2.88 0.00 0.00 179.24 176.23 2dno s GLU 99 N -2.47 0.23 -0.18 0.28 0.41 -1.07 -5.03 118.70 110.87 2dno s GLU 99 Ca -0.18 -0.12 -0.08 0.00 -0.41 0.00 0.00 54.97 54.18 2dno s GLU 99 Cb 0.04 -0.21 0.07 0.00 -1.78 0.00 0.00 34.13 32.25 2dno s GLU 99 CO 0.79 0.06 0.40 0.00 -0.49 0.00 0.00 175.26 176.02 2dno s THR 101 N 2.06 -0.01 -0.21 0.00 2.01 -0.91 -5.03 115.64 113.56 2dno s THR 101 Ca -0.05 0.04 -0.15 0.00 0.31 0.00 0.00 61.69 61.85 2dno s THR 101 Cb -0.10 -0.35 -0.04 0.00 0.01 0.00 0.00 72.50 72.01 2dno s THR 101 CO -0.12 0.02 0.35 -0.69 -0.69 0.00 0.00 174.62 173.48 2dno s VAL 102 N 0.47 5.23 -0.23 3.82 1.01 -1.26 -0.66 120.40 128.78 2dno s VAL 102 Ca -0.03 0.60 -0.29 0.00 0.00 0.00 0.00 61.98 62.27 2dno s VAL 102 Cb -0.04 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 2dno s VAL 102 CO -0.02 0.27 1.87 -0.76 0.00 0.00 0.00 175.10 176.46 2dno s LEU 103 N 1.25 3.70 0.52 3.92 1.43 0.59 -4.96 118.68 125.13 2dno s LEU 103 Ca 0.17 1.70 0.01 0.00 -1.03 0.00 0.00 54.13 54.98 2dno s LEU 103 Cb -0.14 -3.52 -0.01 0.00 0.03 0.00 0.00 46.19 42.54 2dno s LEU 103 CO 0.07 -1.57 0.02 -0.13 0.23 0.00 0.00 176.35 174.97 2dno s ARG 104 N 5.42 2.21 0.03 1.70 0.52 -1.26 -2.74 118.95 124.82 2dno s ARG 104 Ca 0.84 -2.40 0.00 0.00 -0.52 0.00 0.00 55.73 53.65 2dno s ARG 104 Cb -0.28 -1.55 0.00 0.00 0.52 0.00 0.00 34.95 33.64 2dno s ARG 104 CO 0.34 -0.38 0.02 0.41 0.02 0.00 0.00 175.30 175.70 2dno n GLY 105 N -1.30 3.35 0.25 -3.53 0.00 -1.19 -4.91 105.19 97.87 2dno n GLY 105 Ca -0.19 -2.19 -0.07 0.00 0.00 0.00 0.00 46.02 43.57 2dno n GLY 105 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2dno h PRO 106 N 0.00 -0.19 -0.68 1.61 0.11 -2.02 -1.83 132.00 129.00 2dno h PRO 106 Ca -0.02 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.05 2dno h PRO 106 Cb 0.07 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.19 2dno h PRO 106 CO 0.03 -0.13 0.22 0.22 -0.21 0.00 0.00 178.00 178.13 2dno h ASP 107 N -0.20 0.97 0.00 -2.05 1.82 -2.07 -3.46 116.42 111.43 2dno h ASP 107 Ca 0.04 -0.17 0.00 0.00 -0.39 0.00 0.00 57.03 56.52 2dno h ASP 107 Cb 0.32 -0.25 0.00 0.00 0.68 0.00 0.00 39.33 40.07 2dno h ASP 107 CO -0.34 0.90 0.00 0.61 -1.61 0.00 0.00 179.24 178.79 2dno n GLY 108 N -0.84 1.30 3.67 -0.78 0.00 -0.69 -5.12 105.19 102.74 2dno n GLY 108 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 2dno n GLY 108 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dno s THR 109 N -2.00 5.02 -0.67 2.61 -4.23 -1.26 -4.74 115.64 110.37 2dno s THR 109 Ca 0.00 1.24 -0.26 0.00 -1.18 0.00 0.00 61.69 61.49 2dno s THR 109 Cb 0.00 -3.96 -0.11 0.00 1.34 0.00 0.00 72.50 69.77 2dno s THR 109 CO 0.00 0.13 2.41 -0.44 -0.54 0.00 0.00 174.62 176.19 2dno s SER 110 N 1.11 4.08 0.66 3.99 0.01 -1.26 -3.19 113.70 119.10 2dno s SER 110 Ca 0.30 0.46 0.22 0.00 1.31 0.00 0.00 55.95 58.25 2dno s SER 110 Cb -0.16 -2.53 1.21 0.00 0.21 0.00 0.00 66.02 64.75 2dno s SER 110 CO 0.11 -3.51 1.68 0.11 0.41 0.00 0.00 173.24 172.05 2dno h LYS 111 N 15.45 0.00 0.00 12.44 1.79 -1.86 -3.44 116.57 140.95 2dno h LYS 111 Ca -0.09 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 2dno h LYS 111 Cb 1.11 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 2dno h LYS 111 CO 1.07 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.85 2dno n GLY 112 N -1.31 1.71 3.33 3.86 0.00 -1.26 -4.96 105.19 106.57 2dno n GLY 112 Ca -0.01 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 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 0.43 -0.00 -0.21 0.00 0.00 -0.70 -0.30 121.76 120.98 2dno s ALA 114 Ca -0.02 -0.21 -0.14 0.00 0.00 0.00 0.00 51.96 51.60 2dno s ALA 114 Cb -0.04 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 2dno s ALA 114 CO -0.02 -0.08 0.30 -0.06 0.00 0.00 0.00 175.76 175.90 2dno s PHE 115 N -0.66 3.36 -0.20 0.00 0.08 0.16 -1.74 117.98 118.99 2dno s PHE 115 Ca -0.07 0.47 -0.01 0.00 0.12 0.00 0.00 56.93 57.44 2dno s PHE 115 Cb -0.05 -2.41 0.01 0.00 -0.57 0.00 0.00 43.02 40.00 2dno s PHE 115 CO -0.00 0.04 -0.13 0.08 -0.10 0.00 0.00 175.22 175.11 2dno s VAL 116 N 1.13 2.64 -0.46 -0.44 1.01 -0.78 -2.13 120.40 121.37 2dno s VAL 116 Ca 0.15 -0.75 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 2dno s VAL 116 Cb -0.14 -2.16 0.10 0.00 0.00 0.00 0.00 36.38 34.18 2dno s VAL 116 CO 0.06 0.48 0.32 -0.75 0.00 0.00 0.00 175.10 175.21 2dno s LYS 117 N 1.37 2.56 1.00 2.72 2.20 0.53 -0.54 119.74 129.59 2dno s LYS 117 Ca 0.05 -1.64 -0.13 0.00 -0.36 0.00 0.00 55.97 53.90 2dno s LYS 117 Cb -0.14 -3.90 0.19 0.00 -1.51 0.00 0.00 37.83 32.47 2dno s LYS 117 CO -0.09 -1.11 1.10 -0.06 -0.36 0.00 0.00 175.35 174.83 2dno s PHE 118 N 1.41 2.11 0.26 4.03 0.40 -1.26 -1.18 117.98 123.75 2dno s PHE 118 Ca 0.05 0.94 -0.02 0.00 -0.60 0.00 0.00 56.93 57.30 2dno s PHE 118 Cb -0.25 -3.29 0.34 0.00 0.51 0.00 0.00 43.02 40.33 2dno s PHE 118 CO 0.01 -2.90 1.77 0.37 0.70 0.00 0.00 175.22 175.17 2dno h GLN 119 N -1.90 0.82 -4.17 0.44 4.15 -0.98 -3.41 115.11 110.05 2dno h GLN 119 Ca -0.55 -0.21 -0.22 0.00 0.77 0.00 0.00 58.65 58.45 2dno h GLN 119 Cb 1.33 -0.10 -0.11 0.00 0.21 0.00 0.00 27.48 28.82 2dno h GLN 119 CO 0.58 0.80 -0.31 0.95 -1.93 0.00 0.00 178.83 178.92 2dno s THR 120 N -5.05 0.00 0.04 2.39 -4.23 -1.26 -5.03 115.64 102.50 2dno s THR 120 Ca -0.10 -1.68 -0.27 0.00 -1.18 0.00 0.00 61.69 58.47 2dno s THR 120 Cb 0.15 -2.46 -0.15 0.00 1.34 0.00 0.00 72.50 71.38 2dno s THR 120 CO 0.81 0.00 1.34 -0.74 -0.54 0.00 0.00 174.62 175.49 2dno h HIS 121 N 2.29 -0.89 -0.53 3.99 -0.00 -1.94 -2.64 115.15 115.43 2dno h HIS 121 Ca -0.29 -0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.10 2dno h HIS 121 Cb 1.24 0.29 -0.06 0.00 -0.00 0.00 0.00 27.41 28.88 2dno h HIS 121 CO 0.87 -0.55 -0.31 0.00 -0.00 0.00 0.00 177.93 177.94 2dno n ALA 122 N -2.51 -0.34 -0.28 5.26 0.00 -1.26 0.80 120.51 122.18 2dno n ALA 122 Ca -0.12 0.45 0.10 0.00 0.00 0.00 0.00 53.44 53.87 2dno n ALA 122 Cb 0.38 0.08 0.25 0.00 0.00 0.00 0.00 19.45 20.15 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 0.24 -0.89 0.00 3.07 -1.82 0.41 114.58 115.60 2dno h GLU 123 Ca 0.08 -0.01 0.10 0.00 -0.50 0.00 0.00 59.36 59.03 2dno h GLU 123 Cb 0.22 -0.06 -0.06 0.00 -0.84 0.00 0.00 28.75 28.01 2dno h GLU 123 CO -0.50 0.16 0.57 0.00 -1.40 0.00 0.00 179.01 177.85 2dno h ALA 124 N 1.71 1.65 -0.02 3.43 0.00 0.77 -2.42 119.26 124.39 2dno h ALA 124 Ca 0.50 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.40 2dno h ALA 124 Cb 0.94 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 2dno h ALA 124 CO -0.59 0.16 -0.02 0.37 0.00 0.00 0.00 179.25 179.17 2dno h GLN 125 N 0.86 0.04 -0.96 0.00 5.75 0.86 -3.27 115.11 118.40 2dno h GLN 125 Ca 0.41 -0.02 0.14 0.00 -0.15 0.00 0.00 58.65 59.04 2dno h GLN 125 Cb 0.43 0.00 -0.15 0.00 1.07 0.00 0.00 27.48 28.83 2dno h GLN 125 CO -0.18 0.51 -0.40 0.00 -2.65 0.00 0.00 178.83 176.12 2dno n ALA 126 N -2.35 -0.18 0.01 3.38 0.00 -0.64 -0.98 120.51 119.75 2dno n ALA 126 Ca -0.08 0.94 -0.02 0.00 0.00 0.00 0.00 53.44 54.28 2dno n ALA 126 Cb 0.26 -0.39 -0.01 0.00 0.00 0.00 0.00 19.45 19.31 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 1.22 -0.56 -0.81 0.00 0.00 -1.59 -2.81 119.26 114.72 2dno h ALA 127 Ca 0.31 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.32 2dno h ALA 127 Cb 0.55 0.54 -0.13 0.00 0.00 0.00 0.00 17.79 18.75 2dno h ALA 127 CO -0.95 -0.58 -0.45 0.82 0.00 0.00 0.00 179.25 178.09 2dno h ILE 128 N -0.08 0.04 -0.79 0.00 2.04 -1.37 1.10 117.51 118.46 2dno h ILE 128 Ca 0.00 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.13 2dno h ILE 128 Cb 0.08 0.04 -0.14 0.00 -0.74 0.00 0.00 36.82 36.06 2dno h ILE 128 CO -0.04 0.00 0.21 -3.20 0.00 0.00 0.00 178.15 175.12 2dno n ASN 129 N -5.39 0.08 0.00 1.72 2.85 -0.15 -1.04 115.26 113.33 2dno n ASN 129 Ca 0.05 1.32 0.00 0.00 -0.11 0.00 0.00 54.58 55.84 2dno n ASN 129 Cb 0.35 -0.56 0.00 0.00 1.24 0.00 0.00 39.78 40.81 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 -4.95 0.00 -0.29 -0.44 -1.04 0.92 -4.72 114.28 103.75 2dno n THR 130 Ca 0.24 0.31 -0.05 0.00 -2.04 0.00 0.00 64.05 62.51 2dno n THR 130 Cb 0.80 -1.29 -0.03 0.00 -1.82 0.00 0.00 70.33 68.00 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 -2.29 -0.64 -3.28 -4.42 4.77 0.34 -4.06 117.00 107.43 2dno n LEU 131 Ca 0.00 1.27 -0.42 0.00 -0.03 0.00 0.00 56.01 56.83 2dno n LEU 131 Cb 0.00 -0.22 -0.10 0.00 -2.33 0.00 0.00 43.42 40.77 2dno n LEU 131 CO 0.00 -1.08 1.41 1.57 -1.33 0.00 0.00 177.39 177.96 2dno n HIS 132 N -4.97 0.76 -3.46 -1.77 -0.00 -0.21 0.16 115.22 105.73 2dno n HIS 132 Ca 0.04 0.51 -0.18 0.00 0.46 0.00 0.00 57.72 58.55 2dno n HIS 132 Cb 0.23 -1.76 0.08 0.00 -0.12 0.00 0.00 29.99 28.42 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 6.29 -2.12 0.00 0.26 2.88 0.78 -4.93 113.62 116.77 2dno n SER 133 Ca 0.44 -0.66 0.00 0.00 -1.33 0.00 0.00 58.87 57.32 2dno n SER 133 Cb -0.02 -4.96 0.00 0.00 -0.75 0.00 0.00 64.21 58.48 2dno n SER 133 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dno n SER 134 N -3.12 0.00 -5.01 -3.46 2.88 0.41 -4.87 113.62 100.46 2dno n SER 134 Ca -0.28 0.01 -0.19 0.00 -1.33 0.00 0.00 58.87 57.07 2dno n SER 134 Cb 0.67 -0.25 0.06 0.00 -0.75 0.00 0.00 64.21 63.93 2dno n SER 134 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dno s ARG 135 N -0.50 2.35 -0.49 -1.46 1.70 -1.26 -4.86 118.95 114.42 2dno s ARG 135 Ca 0.00 -1.55 0.05 0.00 -0.47 0.00 0.00 55.73 53.76 2dno s ARG 135 Cb 0.00 -2.65 0.19 0.00 -0.57 0.00 0.00 34.95 31.92 2dno s ARG 135 CO 0.00 -0.81 0.44 2.41 -1.08 0.00 0.00 175.30 176.26 2dno n THR 136 N -2.22 -0.21 -1.16 4.99 -1.04 -1.26 0.03 114.28 113.41 2dno n THR 136 Ca 0.15 -3.99 -0.39 0.00 -2.04 0.00 0.00 64.05 57.77 2dno n THR 136 Cb 0.61 -1.86 -0.02 0.00 -1.82 0.00 0.00 70.33 67.24 2dno n THR 136 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2dno n LEU 137 N 2.23 -1.43 -4.67 -4.42 4.77 -1.26 -4.64 117.00 107.58 2dno n LEU 137 Ca 0.26 0.88 -0.58 0.00 -0.03 0.00 0.00 56.01 56.55 2dno n LEU 137 Cb 0.45 -0.79 -0.08 0.00 -2.33 0.00 0.00 43.42 40.68 2dno n LEU 137 CO 0.17 -2.81 1.39 -2.65 -1.33 0.00 0.00 177.39 172.15 2dno n PRO 138 N 0.92 1.04 -1.91 3.23 -0.02 -1.26 -2.37 135.00 134.63 2dno n PRO 138 Ca 0.14 0.37 -0.01 0.00 -2.02 0.00 0.00 63.50 61.98 2dno n PRO 138 Cb 0.25 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2dno n PRO 138 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dno n GLY 139 N 4.57 0.53 2.61 -1.23 0.00 -1.26 -4.88 105.19 105.54 2dno n GLY 139 Ca 0.29 -0.38 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.02 0.40 0.00 4.61 0.00 -1.00 -4.89 121.76 117.87 2dno s ALA 140 Ca 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.70 2dno s ALA 140 Cb -0.00 -1.01 0.00 0.00 0.00 0.00 0.00 23.12 22.11 2dno s ALA 140 CO 0.04 -1.13 0.44 0.43 0.00 0.00 0.00 175.76 175.54 2dno n SER 141 N 5.28 0.00 -3.55 0.00 7.64 -1.26 -4.62 113.62 117.11 2dno n SER 141 Ca -0.07 0.44 -0.10 0.00 1.01 0.00 0.00 58.87 60.15 2dno n SER 141 Cb 0.49 -0.13 0.04 0.00 -1.01 0.00 0.00 64.21 63.59 2dno n SER 141 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dno n SER 142 N -1.60 1.13 -4.50 6.43 7.64 -1.26 -5.11 113.62 116.35 2dno n SER 142 Ca 0.00 -1.81 -0.29 0.00 1.01 0.00 0.00 58.87 57.78 2dno n SER 142 Cb 0.00 -0.22 0.18 0.00 -1.01 0.00 0.00 64.21 63.16 2dno n SER 142 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dno s SER 143 N -2.89 2.46 -0.27 6.43 0.01 -1.26 -4.79 113.70 113.38 2dno s SER 143 Ca 0.32 0.96 -0.28 0.00 1.31 0.00 0.00 55.95 58.26 2dno s SER 143 Cb -0.03 -1.49 -0.05 0.00 0.21 0.00 0.00 66.02 64.66 2dno s SER 143 CO 0.20 -3.21 2.26 -0.11 0.41 0.00 0.00 173.24 172.80 2dno n LEU 144 N -4.20 3.07 -4.67 2.44 7.94 0.10 -4.73 117.00 116.96 2dno n LEU 144 Ca 0.07 0.07 -0.43 0.00 -1.11 0.00 0.00 56.01 54.62 2dno n LEU 144 Cb 0.58 -1.56 -0.02 0.00 0.53 0.00 0.00 43.42 42.95 2dno n LEU 144 CO 0.54 -0.86 0.87 -0.69 -1.11 0.00 0.00 177.39 176.15 2dno s VAL 145 N 9.06 4.69 -0.13 1.96 1.01 -1.22 -0.16 120.40 135.61 2dno s VAL 145 Ca 1.01 2.00 -0.03 0.00 0.00 0.00 0.00 61.98 64.96 2dno s VAL 145 Cb -0.31 -4.29 0.05 0.00 0.00 0.00 0.00 36.38 31.83 2dno s VAL 145 CO 0.34 -0.09 0.04 -0.69 0.00 0.00 0.00 175.10 174.70 2dno s VAL 146 N 2.62 0.26 0.24 2.92 1.01 -1.26 -0.48 120.40 125.71 2dno s VAL 146 Ca 0.47 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.34 2dno s VAL 146 Cb -0.17 -0.66 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 2dno s VAL 146 CO 0.13 -0.03 0.28 2.29 0.00 0.00 0.00 175.10 177.77 2dno n LYS 147 N 5.17 0.41 -2.68 2.72 2.85 -0.77 -4.52 118.16 121.34 2dno n LYS 147 Ca -0.07 -2.17 -0.38 0.00 -1.05 0.00 0.00 58.31 54.64 2dno n LYS 147 Cb 0.49 1.94 -0.06 0.00 -0.65 0.00 0.00 35.03 36.75 2dno n LYS 147 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2dno s PHE 148 N -3.26 3.66 0.25 5.58 0.08 -1.26 0.90 117.98 123.93 2dno s PHE 148 Ca 0.24 1.77 -0.30 0.00 0.12 0.00 0.00 56.93 58.77 2dno s PHE 148 Cb 0.00 -3.03 -0.09 0.00 -0.57 0.00 0.00 43.02 39.33 2dno s PHE 148 CO 0.17 -0.01 0.99 0.00 -0.10 0.00 0.00 175.22 176.27 2dno s ALA 149 N -1.46 3.36 -0.68 5.36 0.00 -0.85 -4.36 121.76 123.13 2dno s ALA 149 Ca 0.49 0.70 -0.15 0.00 0.00 0.00 0.00 51.96 53.00 2dno s ALA 149 Cb -0.23 -3.24 0.17 0.00 0.00 0.00 0.00 23.12 19.82 2dno s ALA 149 CO 0.29 0.10 0.63 -0.51 0.00 0.00 0.00 175.76 176.27 2dno s ASP 150 N -1.09 6.46 0.21 0.00 1.11 -1.26 -4.86 116.67 117.23 2dno s ASP 150 Ca 0.42 -2.22 0.10 0.00 0.18 0.00 0.00 52.55 51.03 2dno s ASP 150 Cb -0.28 -2.21 -0.04 0.00 1.07 0.00 0.00 42.92 41.46 2dno s ASP 150 CO 0.35 -0.72 -0.14 0.28 1.18 0.00 0.00 175.17 176.12 2dno s THR 151 N 0.91 2.88 0.16 -1.27 -1.32 -1.26 -5.15 115.64 110.59 2dno s THR 151 Ca 0.10 -1.89 0.03 0.00 -1.21 0.00 0.00 61.69 58.72 2dno s THR 151 Cb -0.20 -2.44 -0.05 0.00 -1.51 0.00 0.00 72.50 68.30 2dno s THR 151 CO -0.03 -0.18 -0.06 -1.83 -2.21 0.00 0.00 174.62 170.31 2dno s GLU 152 N -2.96 1.09 -0.02 7.08 4.04 -1.26 -5.16 118.70 121.50 2dno s GLU 152 Ca 0.25 -1.49 0.07 0.00 0.04 0.00 0.00 54.97 53.84 2dno s GLU 152 Cb -0.08 -0.51 -0.02 0.00 0.02 0.00 0.00 34.13 33.55 2dno s GLU 152 CO 0.14 -0.00 -0.24 -1.59 -1.84 0.00 0.00 175.26 171.73 2dno s LYS 153 N -3.81 2.01 -0.92 -4.83 -2.85 -1.26 -5.04 119.74 103.04 2dno s LYS 153 Ca 0.19 -0.86 -0.32 0.00 -1.00 0.00 0.00 55.97 53.98 2dno s LYS 153 Cb 0.04 -1.91 -0.21 0.00 -2.06 0.00 0.00 37.83 33.69 2dno s LYS 153 CO 0.02 0.50 2.62 -1.91 0.10 0.00 0.00 175.35 176.68 2dno n GLU 154 N 2.54 0.04 -4.09 1.78 2.13 -1.26 -4.88 120.64 116.90 2dno n GLU 154 Ca -0.16 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.44 2dno n GLU 154 Cb 0.52 -1.56 -0.04 0.00 0.27 0.00 0.00 31.44 30.63 2dno n GLU 154 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2dno s SER 155 N 8.72 5.66 0.00 4.31 0.01 -1.26 -4.89 113.70 126.25 2dno s SER 155 Ca 1.33 -0.19 0.00 0.00 1.31 0.00 0.00 55.95 58.40 2dno s SER 155 Cb -1.26 -1.48 0.00 0.00 0.21 0.00 0.00 66.02 63.49 2dno s SER 155 CO 0.50 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.73 2dno n GLY 156 N -1.15 1.48 3.68 3.44 0.00 -1.26 -5.08 105.19 106.31 2dno n GLY 156 Ca -0.08 -0.63 -0.57 0.00 0.00 0.00 0.00 46.02 44.74 2dno n GLY 156 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dno n PRO 157 N 0.00 1.05 -3.70 1.61 -0.02 -1.26 -4.96 135.00 127.72 2dno n PRO 157 Ca 0.00 0.38 -0.26 0.00 -2.02 0.00 0.00 63.50 61.60 2dno n PRO 157 Cb 0.00 -2.04 -0.17 0.00 -0.02 0.00 0.00 33.50 31.27 2dno n PRO 157 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2dno s SER 158 N 2.68 2.41 0.51 2.55 0.01 -1.26 -5.13 113.70 115.47 2dno s SER 158 Ca 0.95 -0.58 -0.21 0.00 1.31 0.00 0.00 55.95 57.42 2dno s SER 158 Cb -1.08 -0.44 -0.06 0.00 0.21 0.00 0.00 66.02 64.65 2dno s SER 158 CO 0.62 -0.29 1.15 -0.55 0.41 0.00 0.00 173.24 174.58 2dno s SER 159 N 1.97 5.89 0.00 2.44 0.15 -1.26 -5.33 113.70 117.56 2dno s SER 159 Ca 0.01 2.26 0.00 0.00 0.70 0.00 0.00 55.95 58.92 2dno s SER 159 Cb -0.16 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 2dno s SER 159 CO -0.07 -1.11 0.00 0.61 1.20 0.00 0.00 173.24 173.87