#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 1.84 -4.07 1.61 7.64 -1.26 -4.96 113.62 114.42 2dno n SER 60 Ca 0.00 1.11 -0.20 0.00 1.01 0.00 0.00 58.87 60.78 2dno n SER 60 Cb 0.00 -1.17 -0.09 0.00 -1.01 0.00 0.00 64.21 61.93 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 1.32 1.89 0.74 6.43 0.01 -1.26 -5.17 113.70 117.67 2dno s SER 61 Ca 0.88 -1.56 -0.08 0.00 1.31 0.00 0.00 55.95 56.51 2dno s SER 61 Cb -0.99 0.36 0.08 0.00 0.21 0.00 0.00 66.02 65.68 2dno s SER 61 CO 0.52 -0.86 1.06 -0.83 0.41 0.00 0.00 173.24 173.54 2dno s GLY 62 N -3.43 1.69 0.03 3.44 0.00 -1.26 -5.05 107.32 102.74 2dno s GLY 62 Ca 0.33 -0.99 -0.01 0.00 0.00 0.00 0.00 44.72 44.05 2dno s GLY 62 CO 0.17 -0.53 -0.03 1.44 0.00 0.00 0.00 173.10 174.15 2dno n SER 63 N -3.04 0.72 -4.75 1.64 7.64 -1.26 -5.04 113.62 109.53 2dno n SER 63 Ca 0.09 0.10 -0.41 0.00 1.01 0.00 0.00 58.87 59.66 2dno n SER 63 Cb 0.60 -0.23 -0.03 0.00 -1.01 0.00 0.00 64.21 63.54 2dno n SER 63 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dno s SER 64 N -5.63 7.01 0.00 6.43 0.15 -1.26 -5.02 113.70 115.38 2dno s SER 64 Ca -0.02 2.42 0.00 0.00 0.70 0.00 0.00 55.95 59.05 2dno s SER 64 Cb 0.01 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2dno s SER 64 CO 0.03 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.71 2dno n GLY 65 N 1.45 4.63 3.63 9.45 0.00 -1.26 -5.10 105.19 117.98 2dno n GLY 65 Ca 0.01 -1.43 -0.38 0.00 0.00 0.00 0.00 46.02 44.22 2dno n GLY 65 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dno s SER 66 N 0.85 6.23 -0.25 1.61 1.04 -1.26 -5.06 113.70 116.86 2dno s SER 66 Ca 0.00 0.26 -0.11 0.00 0.48 0.00 0.00 55.95 56.58 2dno s SER 66 Cb 0.00 -2.18 -0.05 0.00 0.10 0.00 0.00 66.02 63.89 2dno s SER 66 CO 0.00 -0.08 0.19 -0.60 0.98 0.00 0.00 173.24 173.73 2dno s ARG 67 N 1.61 4.03 -0.45 4.02 3.52 -1.26 -5.02 118.95 125.40 2dno s ARG 67 Ca 0.13 -0.25 0.05 0.00 -0.13 0.00 0.00 55.73 55.53 2dno s ARG 67 Cb -0.15 -3.59 0.18 0.00 -1.56 0.00 0.00 34.95 29.83 2dno s ARG 67 CO 0.08 -0.05 0.49 0.20 -0.81 0.00 0.00 175.30 175.21 2dno s GLY 68 N 1.35 0.14 0.18 8.12 0.00 -1.26 -5.00 107.32 110.85 2dno s GLY 68 Ca 0.08 -1.53 -0.14 0.00 0.00 0.00 0.00 44.72 43.13 2dno s GLY 68 CO 0.07 2.77 1.68 -2.09 0.00 0.00 0.00 173.10 175.53 2dno h GLU 69 N 5.55 0.08 -6.28 2.90 4.57 -2.00 -3.42 114.58 115.98 2dno h GLU 69 Ca 0.17 -0.00 -0.60 0.00 -1.18 0.00 0.00 59.36 57.74 2dno h GLU 69 Cb 1.00 -0.02 0.16 0.00 -0.16 0.00 0.00 28.75 29.74 2dno h GLU 69 CO 0.22 0.05 -0.62 -0.25 -1.18 0.00 0.00 179.01 177.24 2dno n ASP 70 N -5.26 -1.73 -0.08 1.04 8.00 -1.26 -4.91 116.55 112.35 2dno n ASP 70 Ca 0.05 0.79 -0.10 0.00 0.71 0.00 0.00 54.79 56.23 2dno n ASP 70 Cb 0.26 -1.05 -0.06 0.00 -0.02 0.00 0.00 41.12 40.25 2dno n ASP 70 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2dno h ARG 71 N 0.39 0.00 -6.02 -1.24 3.08 -1.95 -3.47 114.38 105.17 2dno h ARG 71 Ca -0.42 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 58.97 2dno h ARG 71 Cb 1.42 0.00 0.12 0.00 0.08 0.00 0.00 29.97 31.58 2dno h ARG 71 CO 0.47 0.44 -0.57 1.17 -1.07 0.00 0.00 179.97 180.42 2dno n LYS 72 N -4.59 0.06 -4.50 0.04 4.81 -1.26 -4.56 118.16 108.17 2dno n LYS 72 Ca -0.14 0.02 -0.24 0.00 -0.87 0.00 0.00 58.31 57.08 2dno n LYS 72 Cb 0.38 -1.04 -0.14 0.00 0.02 0.00 0.00 35.03 34.25 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 3.09 2.20 -0.29 3.14 1.43 0.16 -1.62 118.68 126.80 2dno s LEU 73 Ca 0.63 -0.56 -0.12 0.00 -1.03 0.00 0.00 54.13 53.05 2dno s LEU 73 Cb -0.87 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 2dno s LEU 73 CO 0.57 0.11 0.23 0.12 0.23 0.00 0.00 176.35 177.62 2dno s PHE 74 N -0.91 3.22 -0.07 0.29 2.19 0.15 -1.61 117.98 121.25 2dno s PHE 74 Ca 0.06 0.13 0.01 0.00 0.33 0.00 0.00 56.93 57.46 2dno s PHE 74 Cb -0.09 -2.43 -0.03 0.00 -1.31 0.00 0.00 43.02 39.16 2dno s PHE 74 CO 0.02 -0.20 -0.08 0.08 1.83 0.00 0.00 175.22 176.88 2dno s VAL 75 N 1.82 3.64 0.16 3.12 1.01 -0.46 -1.64 120.40 128.05 2dno s VAL 75 Ca 0.08 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.59 2dno s VAL 75 Cb -0.16 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.72 2dno s VAL 75 CO 0.11 0.59 0.07 0.61 0.00 0.00 0.00 175.10 176.48 2dno n GLY 76 N 2.37 3.71 2.88 4.51 0.00 0.75 -1.86 105.19 117.54 2dno n GLY 76 Ca -0.18 -1.95 -0.22 0.00 0.00 0.00 0.00 46.02 43.67 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 -0.36 -4.07 -3.12 1.61 2.81 -1.06 -3.11 117.12 109.81 2dno n MET 77 Ca -0.01 0.92 -0.27 0.00 -1.81 0.00 0.00 57.70 56.53 2dno n MET 77 Cb 0.25 -5.73 -0.02 0.00 -0.71 0.00 0.00 33.22 27.01 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 -6.52 3.91 0.20 4.03 1.43 -1.14 -4.72 118.68 115.87 2dno s LEU 78 Ca 0.23 0.72 0.10 0.00 -1.03 0.00 0.00 54.13 54.15 2dno s LEU 78 Cb -0.10 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.48 2dno s LEU 78 CO 0.29 -0.35 -0.21 -0.83 0.23 0.00 0.00 176.35 175.48 2dno s GLY 79 N -3.70 1.61 0.31 -3.19 0.00 -1.26 -4.33 107.32 96.76 2dno s GLY 79 Ca 0.44 -1.62 0.08 0.00 0.00 0.00 0.00 44.72 43.62 2dno s GLY 79 CO 0.36 -1.67 1.72 1.70 0.00 0.00 0.00 173.10 175.21 2dno h LYS 80 N 3.06 0.50 -0.23 2.90 3.64 -1.92 -0.85 116.57 123.67 2dno h LYS 80 Ca -0.44 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 58.97 2dno h LYS 80 Cb 1.22 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 32.85 2dno h LYS 80 CO 0.51 0.33 -0.30 1.96 -2.27 0.00 0.00 179.45 179.69 2dno h GLN 81 N 0.52 -0.31 -6.88 1.90 1.08 -1.95 -3.41 115.11 106.06 2dno h GLN 81 Ca 0.62 0.02 -0.50 0.00 -1.45 0.00 0.00 58.65 57.34 2dno h GLN 81 Cb 1.18 0.07 0.03 0.00 -0.05 0.00 0.00 27.48 28.71 2dno h GLN 81 CO -0.49 -0.21 0.48 -0.65 -0.95 0.00 0.00 178.83 177.01 2dno s GLN 82 N -6.02 4.37 0.20 1.46 -1.52 -0.33 -5.02 119.66 112.80 2dno s GLN 82 Ca -0.15 1.79 -0.01 0.00 -1.95 0.00 0.00 55.36 55.04 2dno s GLN 82 Cb 0.12 -2.92 -0.04 0.00 -0.22 0.00 0.00 33.01 29.95 2dno s GLN 82 CO 0.67 -0.03 0.13 0.95 -0.25 0.00 0.00 175.29 176.76 2dno s THR 83 N -1.32 0.02 0.34 -0.19 -4.23 -1.26 -4.68 115.64 104.32 2dno s THR 83 Ca 0.51 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 59.25 2dno s THR 83 Cb -0.30 -2.49 0.37 0.00 1.34 0.00 0.00 72.50 71.42 2dno s THR 83 CO 0.39 -0.02 1.31 -0.67 -0.54 0.00 0.00 174.62 175.08 2dno n ASP 84 N -0.27 0.22 0.37 3.99 2.03 -1.26 0.70 116.55 122.33 2dno n ASP 84 Ca 0.02 1.25 -0.18 0.00 0.52 0.00 0.00 54.79 56.40 2dno n ASP 84 Cb 0.66 -0.61 -0.09 0.00 -0.72 0.00 0.00 41.12 40.36 2dno n ASP 84 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2dno h GLU 85 N 0.00 -0.87 0.54 -0.67 4.22 -1.98 0.16 114.58 115.99 2dno h GLU 85 Ca 0.72 0.06 -0.02 0.00 0.08 0.00 0.00 59.36 60.20 2dno h GLU 85 Cb 2.16 0.20 0.00 0.00 0.50 0.00 0.00 28.75 31.61 2dno h GLU 85 CO -0.49 -0.58 -0.30 -0.44 -2.18 0.00 0.00 179.01 175.02 2dno h ASP 86 N -0.90 -0.72 -0.16 1.04 5.19 -0.11 -1.08 116.42 119.68 2dno h ASP 86 Ca -0.09 0.03 0.05 0.00 -0.62 0.00 0.00 57.03 56.40 2dno h ASP 86 Cb 0.69 0.20 -0.06 0.00 0.18 0.00 0.00 39.33 40.34 2dno h ASP 86 CO 0.15 -0.48 -0.31 0.58 -3.12 0.00 0.00 179.24 176.06 2dno h VAL 87 N -0.78 0.30 0.14 -1.35 2.07 -1.29 1.26 116.25 116.60 2dno h VAL 87 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2dno h VAL 87 Cb 0.62 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2dno h VAL 87 CO 0.09 0.00 -0.28 -0.09 0.02 0.00 0.00 177.57 177.31 2dno h ARG 88 N -0.37 -0.44 0.00 1.57 2.43 -0.61 0.81 114.38 117.77 2dno h ARG 88 Ca 0.10 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2dno h ARG 88 Cb 0.53 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 2dno h ARG 88 CO -0.36 -0.29 0.00 0.87 -1.51 0.00 0.00 179.97 178.67 2dno h LYS 89 N -0.46 0.00 0.00 0.20 1.57 -1.03 0.24 116.57 117.09 2dno h LYS 89 Ca -0.01 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 2dno h LYS 89 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 2dno h LYS 89 CO -0.11 0.00 -0.71 1.98 -0.57 0.00 0.00 179.45 180.03 2dno h MET 90 N 0.00 0.00 0.00 3.15 4.05 0.30 -3.32 114.93 119.11 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 0.07 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.87 2dno h MET 90 CO 0.00 0.16 -1.55 1.19 0.23 0.00 0.00 176.91 176.93 2dno n PHE 91 N -2.94 0.00 -0.29 1.39 3.01 0.27 -4.37 117.46 114.53 2dno n PHE 91 Ca -0.00 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.42 2dno n PHE 91 Cb 0.64 -0.28 0.08 0.00 -0.01 0.00 0.00 39.48 39.90 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 1.02 0.00 -1.08 5.08 -0.73 -2.06 114.58 116.82 2dno h GLU 92 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2dno h GLU 92 Cb 0.77 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2dno h GLU 92 CO 0.00 0.68 0.44 -2.30 -1.00 0.00 0.00 179.01 176.83 2dno n PRO 93 N -4.55 0.06 -0.79 2.33 -0.02 -1.26 0.12 135.00 130.89 2dno n PRO 93 Ca 0.08 0.52 0.01 0.00 -2.02 0.00 0.00 63.50 62.09 2dno n PRO 93 Cb 0.03 -2.14 0.19 0.00 -0.02 0.00 0.00 33.50 31.56 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 -1.92 0.50 0.00 6.00 3.72 -0.77 -5.03 117.46 119.96 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 0.46 -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 3.20 3.72 1.37 0.00 0.32 -4.31 105.19 108.41 2dno n GLY 95 Ca 0.25 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.96 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 -2.25 4.88 -0.11 2.61 2.01 -1.26 -4.04 115.64 117.48 2dno s THR 96 Ca 0.00 1.75 -0.15 0.00 0.31 0.00 0.00 61.69 63.60 2dno s THR 96 Cb 0.00 -4.18 -0.05 0.00 0.01 0.00 0.00 72.50 68.29 2dno s THR 96 CO 0.00 0.25 0.35 -0.63 -0.69 0.00 0.00 174.62 173.90 2dno s ILE 97 N 0.65 5.23 -0.24 1.82 1.01 -1.26 0.58 121.20 128.98 2dno s ILE 97 Ca 0.44 0.69 -0.04 0.00 0.00 0.00 0.00 60.65 61.73 2dno s ILE 97 Cb -0.20 -3.68 -0.14 0.00 0.01 0.00 0.00 42.46 38.46 2dno s ILE 97 CO 0.23 0.43 -0.26 -0.67 0.00 0.00 0.00 174.94 174.68 2dno n ASP 98 N 3.11 2.00 -3.97 3.58 2.03 -0.60 -4.87 116.55 117.83 2dno n ASP 98 Ca -0.12 0.06 -0.21 0.00 0.52 0.00 0.00 54.79 55.04 2dno n ASP 98 Cb 0.52 -0.53 -0.16 0.00 -0.72 0.00 0.00 41.12 40.24 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 -2.47 1.00 -0.18 -0.67 2.12 -1.21 -5.03 118.70 112.26 2dno s GLU 99 Ca -0.33 -0.26 -0.05 0.00 0.36 0.00 0.00 54.97 54.69 2dno s GLU 99 Cb 0.10 -0.92 0.09 0.00 0.26 0.00 0.00 34.13 33.66 2dno s GLU 99 CO 0.50 0.05 0.31 0.00 -0.54 0.00 0.00 175.26 175.58 2dno s THR 101 N 2.46 0.50 0.07 0.00 2.01 -0.67 -5.03 115.64 114.98 2dno s THR 101 Ca 0.04 -0.20 -0.01 0.00 0.31 0.00 0.00 61.69 61.83 2dno s THR 101 Cb -0.13 -0.47 -0.04 0.00 0.01 0.00 0.00 72.50 71.87 2dno s THR 101 CO -0.11 0.17 0.24 -0.69 -0.69 0.00 0.00 174.62 173.54 2dno s VAL 102 N 0.30 5.34 -0.27 3.82 1.01 -1.26 -0.56 120.40 128.78 2dno s VAL 102 Ca -0.04 -0.27 -0.16 0.00 0.00 0.00 0.00 61.98 61.52 2dno s VAL 102 Cb -0.08 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 2dno s VAL 102 CO -0.00 0.14 0.43 -0.76 0.00 0.00 0.00 175.10 174.91 2dno s LEU 103 N -2.47 4.06 0.42 3.92 1.43 -0.82 -4.94 118.68 120.28 2dno s LEU 103 Ca 0.35 0.36 0.05 0.00 -1.03 0.00 0.00 54.13 53.86 2dno s LEU 103 Cb -0.13 -2.52 -0.06 0.00 0.03 0.00 0.00 46.19 43.51 2dno s LEU 103 CO 0.26 -0.24 0.03 -0.13 0.23 0.00 0.00 176.35 176.50 2dno s ARG 104 N 2.18 1.96 0.00 1.70 0.52 -1.26 -3.02 118.95 121.02 2dno s ARG 104 Ca 0.18 -2.15 0.00 0.00 -0.52 0.00 0.00 55.73 53.23 2dno s ARG 104 Cb -0.16 -1.38 0.00 0.00 0.52 0.00 0.00 34.95 33.93 2dno s ARG 104 CO 0.10 -0.19 0.00 0.41 0.02 0.00 0.00 175.30 175.64 2dno n GLY 105 N -0.99 1.45 0.18 -3.53 0.00 -1.17 -4.92 105.19 96.22 2dno n GLY 105 Ca -0.08 -1.70 -0.20 0.00 0.00 0.00 0.00 46.02 44.03 2dno n GLY 105 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dno h PRO 106 N 0.00 0.61 0.02 1.61 0.13 -2.02 -3.35 132.00 129.00 2dno h PRO 106 Ca 0.00 -0.75 -0.07 0.00 -0.87 0.00 0.00 66.00 64.31 2dno h PRO 106 Cb 0.00 0.24 0.01 0.00 0.13 0.00 0.00 31.00 31.37 2dno h PRO 106 CO 0.00 1.33 -0.27 0.22 -0.23 0.00 0.00 178.00 179.04 2dno h ASP 107 N 0.30 0.21 0.00 1.44 3.58 -2.06 -3.48 116.42 116.41 2dno h ASP 107 Ca -0.16 -0.84 0.00 0.00 0.42 0.00 0.00 57.03 56.45 2dno h ASP 107 Cb 1.82 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.80 2dno h ASP 107 CO 0.22 1.03 0.00 0.61 -2.88 0.00 0.00 179.24 178.22 2dno n GLY 108 N 1.23 0.52 3.60 -0.78 0.00 -1.26 -5.15 105.19 103.34 2dno n GLY 108 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.78 3.84 -0.64 2.61 2.01 -1.26 -4.88 115.64 116.54 2dno s THR 109 Ca 0.00 -0.42 -0.26 0.00 0.31 0.00 0.00 61.69 61.32 2dno s THR 109 Cb 0.00 -2.59 -0.06 0.00 0.01 0.00 0.00 72.50 69.87 2dno s THR 109 CO 0.00 0.59 2.13 -0.55 -0.69 0.00 0.00 174.62 176.10 2dno s SER 110 N -0.75 4.79 0.59 3.53 0.15 -1.26 -3.02 113.70 117.73 2dno s SER 110 Ca 0.11 0.40 0.29 0.00 0.70 0.00 0.00 55.95 57.46 2dno s SER 110 Cb -0.11 -2.53 1.41 0.00 -1.71 0.00 0.00 66.02 63.08 2dno s SER 110 CO 0.02 -2.80 1.82 0.11 1.20 0.00 0.00 173.24 173.58 2dno h LYS 111 N 15.72 0.00 0.00 5.44 1.79 -1.89 -3.41 116.57 134.22 2dno h LYS 111 Ca -0.17 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 2dno h LYS 111 Cb 1.15 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.80 2dno h LYS 111 CO 1.17 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.95 2dno n GLY 112 N -1.54 1.69 3.57 3.86 0.00 -1.26 -4.94 105.19 106.57 2dno n GLY 112 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.85 -1.17 -0.17 0.00 0.00 -0.78 -1.94 121.76 116.85 2dno s ALA 114 Ca -0.04 0.32 -0.06 0.00 0.00 0.00 0.00 51.96 52.18 2dno s ALA 114 Cb -0.01 0.54 -0.04 0.00 0.00 0.00 0.00 23.12 23.61 2dno s ALA 114 CO 0.03 -0.57 0.04 -0.06 0.00 0.00 0.00 175.76 175.19 2dno s PHE 115 N -3.06 3.20 -0.06 0.00 0.08 0.28 -1.36 117.98 117.07 2dno s PHE 115 Ca -0.02 -0.01 0.06 0.00 0.12 0.00 0.00 56.93 57.08 2dno s PHE 115 Cb 0.00 -2.04 -0.01 0.00 -0.57 0.00 0.00 43.02 40.40 2dno s PHE 115 CO -0.07 0.13 -0.24 0.08 -0.10 0.00 0.00 175.22 175.02 2dno s VAL 116 N 0.31 2.16 -0.12 -0.44 1.01 -0.63 -1.67 120.40 121.02 2dno s VAL 116 Ca 0.02 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.00 2dno s VAL 116 Cb -0.13 -1.79 0.00 0.00 0.00 0.00 0.00 36.38 34.47 2dno s VAL 116 CO 0.01 0.57 -0.22 -0.75 0.00 0.00 0.00 175.10 174.71 2dno s LYS 117 N -0.19 3.09 0.36 2.72 2.20 0.20 0.40 119.74 128.52 2dno s LYS 117 Ca -0.03 -0.85 0.05 0.00 -0.36 0.00 0.00 55.97 54.79 2dno s LYS 117 Cb -0.14 -2.39 -0.01 0.00 -1.51 0.00 0.00 37.83 33.78 2dno s LYS 117 CO 0.03 0.12 0.52 -0.06 -0.36 0.00 0.00 175.35 175.60 2dno s PHE 118 N 0.51 3.16 0.23 4.03 0.08 -1.26 -1.56 117.98 123.17 2dno s PHE 118 Ca -0.14 -0.08 0.22 0.00 0.12 0.00 0.00 56.93 57.05 2dno s PHE 118 Cb -0.17 -2.06 0.96 0.00 -0.57 0.00 0.00 43.02 41.18 2dno s PHE 118 CO 0.05 -0.08 1.86 0.37 -0.10 0.00 0.00 175.22 177.31 2dno h GLN 119 N 0.77 0.00 -3.45 0.44 5.75 -0.20 -3.42 115.11 115.00 2dno h GLN 119 Ca -0.46 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 57.94 2dno h GLN 119 Cb 1.25 0.00 -0.16 0.00 1.07 0.00 0.00 27.48 29.64 2dno h GLN 119 CO 0.54 0.26 -0.30 0.95 -2.65 0.00 0.00 178.83 177.63 2dno s THR 120 N -3.80 0.10 0.07 2.39 -4.23 -1.26 -5.07 115.64 103.84 2dno s THR 120 Ca -0.01 -0.80 -0.33 0.00 -1.18 0.00 0.00 61.69 59.38 2dno s THR 120 Cb 0.11 -0.99 -0.18 0.00 1.34 0.00 0.00 72.50 72.79 2dno s THR 120 CO 0.65 -0.44 1.62 -0.74 -0.54 0.00 0.00 174.62 175.17 2dno h HIS 121 N 3.20 -0.86 -0.99 3.99 -0.00 -1.91 -2.82 115.15 115.77 2dno h HIS 121 Ca -0.32 -0.02 0.14 0.00 -0.00 0.00 0.00 60.37 60.17 2dno h HIS 121 Cb 1.20 0.30 -0.15 0.00 -0.00 0.00 0.00 27.41 28.75 2dno h HIS 121 CO 0.46 -0.52 -0.43 0.00 -0.00 0.00 0.00 177.93 177.44 2dno h ALA 122 N -0.52 -0.01 -0.06 5.26 0.00 -1.97 0.17 119.26 122.13 2dno h ALA 122 Ca -0.08 0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.10 2dno h ALA 122 Cb 0.69 1.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.51 2dno h ALA 122 CO 0.11 -0.70 -0.44 0.93 0.00 0.00 0.00 179.25 179.15 2dno h GLU 123 N -0.01 -0.53 -0.80 0.00 4.39 -1.81 -2.64 114.58 113.19 2dno h GLU 123 Ca 0.30 0.04 0.07 0.00 0.34 0.00 0.00 59.36 60.11 2dno h GLU 123 Cb 0.56 0.12 -0.10 0.00 -0.10 0.00 0.00 28.75 29.23 2dno h GLU 123 CO -0.97 -0.35 -0.51 0.00 -1.16 0.00 0.00 179.01 176.02 2dno h ALA 124 N -0.03 -0.50 -0.87 3.43 0.00 -0.72 0.12 119.26 120.69 2dno h ALA 124 Ca 0.05 0.09 0.16 0.00 0.00 0.00 0.00 54.91 55.22 2dno h ALA 124 Cb 0.65 1.30 -0.16 0.00 0.00 0.00 0.00 17.79 19.58 2dno h ALA 124 CO -0.36 -0.85 -0.26 0.37 0.00 0.00 0.00 179.25 178.14 2dno h GLN 125 N -0.04 -0.02 0.00 0.00 -0.00 -1.09 -2.14 115.11 111.82 2dno h GLN 125 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.78 2dno h GLN 125 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.86 2dno h GLN 125 CO -0.77 -0.01 0.00 0.00 0.00 0.00 0.00 178.83 178.04 2dno n ALA 126 N -3.42 -0.01 -0.34 3.38 0.00 0.40 -0.14 120.51 120.39 2dno n ALA 126 Ca 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.45 2dno n ALA 126 Cb 0.43 0.47 -0.09 0.00 0.00 0.00 0.00 19.45 20.26 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 -1.11 -0.53 -0.79 0.00 0.00 -1.32 0.28 119.26 115.78 2dno h ALA 127 Ca 0.00 0.09 0.19 0.00 0.00 0.00 0.00 54.91 55.19 2dno h ALA 127 Cb 0.00 1.31 -0.12 0.00 0.00 0.00 0.00 17.79 18.97 2dno h ALA 127 CO 0.00 -0.89 0.17 0.82 0.00 0.00 0.00 179.25 179.35 2dno h ILE 128 N -0.05 0.42 -1.03 0.00 2.04 -1.13 1.87 117.51 119.64 2dno h ILE 128 Ca 0.13 -0.08 0.28 0.00 1.00 0.00 0.00 64.86 66.19 2dno h ILE 128 Cb 0.39 0.17 -0.12 0.00 -0.74 0.00 0.00 36.82 36.52 2dno h ILE 128 CO -0.80 0.04 0.62 -1.13 0.00 0.00 0.00 178.15 176.88 2dno h ASN 129 N 0.22 0.58 0.00 1.72 -1.24 0.30 -1.67 115.58 115.50 2dno h ASN 129 Ca 0.46 0.14 0.00 0.00 0.71 0.00 0.00 56.30 57.61 2dno h ASN 129 Cb 0.85 0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.95 2dno h ASN 129 CO -0.59 0.04 -0.23 0.41 -1.29 0.00 0.00 177.43 175.76 2dno n THR 130 N -4.86 0.56 -0.25 -3.57 -1.04 0.82 -4.65 114.28 101.28 2dno n THR 130 Ca 0.28 0.28 0.18 0.00 -2.04 0.00 0.00 64.05 62.75 2dno n THR 130 Cb 0.86 -1.59 0.34 0.00 -1.82 0.00 0.00 70.33 68.12 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 -3.12 0.10 -4.70 -4.42 4.77 0.60 -3.91 117.00 106.32 2dno n LEU 131 Ca -0.03 1.27 -0.58 0.00 -0.03 0.00 0.00 56.01 56.64 2dno n LEU 131 Cb 0.12 -0.55 -0.07 0.00 -2.33 0.00 0.00 43.42 40.59 2dno n LEU 131 CO 0.05 -1.36 1.26 1.57 -1.33 0.00 0.00 177.39 177.58 2dno n HIS 132 N -4.87 1.96 -4.04 -1.77 -0.00 -0.63 -1.30 115.22 104.58 2dno n HIS 132 Ca 0.24 0.62 -0.31 0.00 0.46 0.00 0.00 57.72 58.72 2dno n HIS 132 Cb 0.80 -2.42 -0.05 0.00 -0.12 0.00 0.00 29.99 28.20 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 4.94 -0.72 -0.00 0.26 2.88 0.17 -4.86 113.62 116.28 2dno n SER 133 Ca 0.26 -1.09 -0.00 0.00 -1.33 0.00 0.00 58.87 56.71 2dno n SER 133 Cb 0.11 -1.34 -0.00 0.00 -0.75 0.00 0.00 64.21 62.23 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 -2.12 0.06 -5.01 -3.46 2.88 -0.42 -4.83 113.62 100.71 2dno n SER 134 Ca -0.21 0.01 -0.18 0.00 -1.33 0.00 0.00 58.87 57.16 2dno n SER 134 Cb 0.55 -0.51 0.03 0.00 -0.75 0.00 0.00 64.21 63.53 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 -1.06 2.66 -0.58 -1.46 1.70 -1.26 -4.86 118.95 114.09 2dno s ARG 135 Ca -0.01 -1.34 0.04 0.00 -0.47 0.00 0.00 55.73 53.96 2dno s ARG 135 Cb 0.00 -2.71 0.17 0.00 -0.57 0.00 0.00 34.95 31.83 2dno s ARG 135 CO 0.01 -0.47 0.42 0.99 -1.08 0.00 0.00 175.30 175.17 2dno s THR 136 N -2.46 1.92 0.31 4.99 2.01 -1.26 0.36 115.64 121.50 2dno s THR 136 Ca 0.57 -3.58 -0.25 0.00 0.31 0.00 0.00 61.69 58.75 2dno s THR 136 Cb -0.09 -2.28 -0.16 0.00 0.01 0.00 0.00 72.50 69.99 2dno s THR 136 CO 0.35 -1.07 0.37 0.18 -0.69 0.00 0.00 174.62 173.76 2dno n LEU 137 N 2.41 -1.65 -4.67 4.42 4.77 -1.26 -4.70 117.00 116.32 2dno n LEU 137 Ca 0.22 0.98 -0.57 0.00 -0.03 0.00 0.00 56.01 56.60 2dno n LEU 137 Cb 0.39 -0.96 -0.07 0.00 -2.33 0.00 0.00 43.42 40.45 2dno n LEU 137 CO 0.21 -3.41 1.15 -2.65 -1.33 0.00 0.00 177.39 171.36 2dno n PRO 138 N 1.08 0.98 -2.60 3.23 -0.02 -1.26 -2.23 135.00 134.19 2dno n PRO 138 Ca 0.14 0.36 -0.08 0.00 -2.02 0.00 0.00 63.50 61.90 2dno n PRO 138 Cb 0.33 -2.00 0.04 0.00 -0.02 0.00 0.00 33.50 31.85 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 3.57 -0.02 2.62 -1.23 0.00 -1.26 -4.80 105.19 104.06 2dno n GLY 139 Ca 0.24 -0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.19 0.39 0.00 4.61 0.00 -0.95 -4.85 121.76 117.78 2dno s ALA 140 Ca 0.08 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.82 2dno s ALA 140 Cb -0.01 -0.97 0.00 0.00 0.00 0.00 0.00 23.12 22.14 2dno s ALA 140 CO 0.37 -1.06 0.44 0.43 0.00 0.00 0.00 175.76 175.94 2dno n SER 141 N 5.28 0.00 -3.62 0.00 7.64 -1.26 -4.62 113.62 117.04 2dno n SER 141 Ca -0.06 0.44 -0.11 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 63.60 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 -1.56 1.16 -4.02 6.43 7.64 -1.26 -5.11 113.62 116.90 2dno n SER 142 Ca 0.00 -1.85 -0.30 0.00 1.01 0.00 0.00 58.87 57.73 2dno n SER 142 Cb 0.00 -0.23 0.21 0.00 -1.01 0.00 0.00 64.21 63.18 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 -2.98 1.82 -0.46 6.43 0.01 -1.26 -4.71 113.70 112.55 2dno s SER 143 Ca 0.34 0.58 -0.27 0.00 1.31 0.00 0.00 55.95 57.91 2dno s SER 143 Cb -0.03 -0.81 -0.04 0.00 0.21 0.00 0.00 66.02 65.35 2dno s SER 143 CO 0.21 -3.56 2.07 -0.22 0.41 0.00 0.00 173.24 172.15 2dno s LEU 144 N -6.55 3.39 -0.32 2.44 2.96 0.16 -4.71 118.68 116.05 2dno s LEU 144 Ca 0.71 1.00 -0.29 0.00 -0.22 0.00 0.00 54.13 55.33 2dno s LEU 144 Cb -0.09 -2.88 0.01 0.00 0.50 0.00 0.00 46.19 43.74 2dno s LEU 144 CO 0.55 -2.33 1.16 -0.69 -1.32 0.00 0.00 176.35 173.71 2dno s VAL 145 N 9.47 4.36 -0.07 1.68 1.01 -1.18 0.45 120.40 136.13 2dno s VAL 145 Ca 0.84 1.55 0.04 0.00 0.00 0.00 0.00 61.98 64.41 2dno s VAL 145 Cb -0.19 -4.34 0.00 0.00 0.00 0.00 0.00 36.38 31.85 2dno s VAL 145 CO 0.27 -0.52 -0.19 -0.69 0.00 0.00 0.00 175.10 173.97 2dno s VAL 146 N 3.94 1.64 0.36 2.92 1.01 -1.26 -0.18 120.40 128.83 2dno s VAL 146 Ca 0.49 -0.80 -0.10 0.00 0.00 0.00 0.00 61.98 61.57 2dno s VAL 146 Cb -0.13 -1.42 0.04 0.00 0.00 0.00 0.00 36.38 34.87 2dno s VAL 146 CO 0.19 0.47 0.66 2.29 0.00 0.00 0.00 175.10 178.71 2dno n LYS 147 N 3.37 0.96 -2.74 2.72 2.85 -0.65 -4.62 118.16 120.04 2dno n LYS 147 Ca -0.19 -2.28 -0.33 0.00 -1.05 0.00 0.00 58.31 54.46 2dno n LYS 147 Cb 0.53 2.61 -0.06 0.00 -0.65 0.00 0.00 35.03 37.46 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 -2.69 3.24 -1.29 5.58 0.08 -1.26 0.34 117.98 121.98 2dno s PHE 148 Ca 0.19 1.61 -0.17 0.00 0.12 0.00 0.00 56.93 58.68 2dno s PHE 148 Cb -0.04 -2.92 0.10 0.00 -0.57 0.00 0.00 43.02 39.59 2dno s PHE 148 CO 0.14 -0.30 1.69 0.00 -0.10 0.00 0.00 175.22 176.65 2dno n ALA 149 N -0.68 3.76 -1.78 5.36 0.00 -0.64 -4.13 120.51 122.41 2dno n ALA 149 Ca 0.07 -3.96 -0.35 0.00 0.00 0.00 0.00 53.44 49.21 2dno n ALA 149 Cb 0.53 -3.46 -0.02 0.00 0.00 0.00 0.00 19.45 16.51 2dno n ALA 149 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2dno s ASP 150 N 3.77 6.08 -0.12 0.00 -1.08 -1.26 -4.95 116.67 119.11 2dno s ASP 150 Ca 0.51 2.09 -0.01 0.00 -0.52 0.00 0.00 52.55 54.62 2dno s ASP 150 Cb 0.03 -2.58 0.03 0.00 -1.46 0.00 0.00 42.92 38.95 2dno s ASP 150 CO 0.05 -0.97 -0.04 0.42 0.52 0.00 0.00 175.17 175.15 2dno s THR 151 N -1.81 0.85 0.39 1.71 -4.23 -1.26 -5.12 115.64 106.16 2dno s THR 151 Ca 0.69 -0.30 -0.27 0.00 -1.18 0.00 0.00 61.69 60.63 2dno s THR 151 Cb -0.22 -0.98 -0.09 0.00 1.34 0.00 0.00 72.50 72.55 2dno s THR 151 CO 0.25 0.23 1.33 -0.70 -0.54 0.00 0.00 174.62 175.20 2dno s GLU 152 N 1.77 4.05 0.26 3.99 2.12 -1.26 -5.03 118.70 124.60 2dno s GLU 152 Ca 0.03 2.24 0.11 0.00 0.36 0.00 0.00 54.97 57.71 2dno s GLU 152 Cb -0.14 -2.85 -0.05 0.00 0.26 0.00 0.00 34.13 31.36 2dno s GLU 152 CO -0.07 -0.45 -0.17 -1.59 -0.54 0.00 0.00 175.26 172.43 2dno s LYS 153 N -2.14 1.76 -0.10 4.30 -2.85 -1.26 -5.14 119.74 114.32 2dno s LYS 153 Ca 0.55 -1.67 0.03 0.00 -1.00 0.00 0.00 55.97 53.88 2dno s LYS 153 Cb -0.40 -1.85 -0.01 0.00 -2.06 0.00 0.00 37.83 33.51 2dno s LYS 153 CO 0.52 0.35 -0.20 -1.83 0.10 0.00 0.00 175.35 174.28 2dno s GLU 154 N -3.40 3.07 -0.02 1.78 1.03 -1.26 -5.11 118.70 114.79 2dno s GLU 154 Ca 0.29 -0.82 -0.29 0.00 0.03 0.00 0.00 54.97 54.19 2dno s GLU 154 Cb -0.06 -2.39 0.09 0.00 -0.80 0.00 0.00 34.13 30.97 2dno s GLU 154 CO 0.15 0.24 0.78 0.45 -1.33 0.00 0.00 175.26 175.55 2dno s SER 155 N 0.23 -0.51 0.46 0.83 0.15 -1.26 -5.15 113.70 108.45 2dno s SER 155 Ca -0.13 0.34 -0.24 0.00 0.70 0.00 0.00 55.95 56.61 2dno s SER 155 Cb -0.16 0.46 -0.07 0.00 -1.71 0.00 0.00 66.02 64.54 2dno s SER 155 CO 0.07 -0.63 1.33 -0.83 1.20 0.00 0.00 173.24 174.38 2dno s GLY 156 N -1.79 2.89 -1.08 9.45 0.00 -1.26 -4.91 107.32 110.63 2dno s GLY 156 Ca -0.03 1.27 -0.22 0.00 0.00 0.00 0.00 44.72 45.74 2dno s GLY 156 CO -0.01 1.83 1.57 2.56 0.00 0.00 0.00 173.10 179.05 2dno s PRO 157 N -2.54 3.56 -0.83 2.90 0.04 -1.26 -4.94 135.00 131.93 2dno s PRO 157 Ca 0.63 -1.26 -0.18 0.00 0.04 0.00 0.00 61.00 60.23 2dno s PRO 157 Cb -0.39 -5.37 0.14 0.00 0.04 0.00 0.00 34.50 28.92 2dno s PRO 157 CO 0.48 -2.37 0.98 -1.12 0.04 0.00 0.00 177.00 175.01 2dno s SER 158 N 5.11 6.54 0.16 6.66 0.01 -1.26 -4.92 113.70 126.00 2dno s SER 158 Ca 0.51 -1.97 -0.18 0.00 1.31 0.00 0.00 55.95 55.61 2dno s SER 158 Cb 0.00 -2.35 0.10 0.00 0.21 0.00 0.00 66.02 63.98 2dno s SER 158 CO -0.04 -1.02 1.22 -0.24 0.41 0.00 0.00 173.24 173.57 2dno n SER 159 N 6.15 -0.63 0.00 2.44 2.88 -1.26 -5.31 113.62 117.89 2dno n SER 159 Ca 0.14 1.38 0.00 0.00 -1.33 0.00 0.00 58.87 59.07 2dno n SER 159 Cb 0.47 -0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.67 2dno n SER 159 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42