#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 6.36 -0.19 1.61 0.01 -1.26 -5.10 113.70 115.13 2dno s SER 60 Ca 0.00 0.48 -0.33 0.00 1.31 0.00 0.00 55.95 57.41 2dno s SER 60 Cb 0.00 -2.04 0.14 0.00 0.21 0.00 0.00 66.02 64.33 2dno s SER 60 CO 0.00 -0.18 1.17 -0.55 0.41 0.00 0.00 173.24 174.10 2dno s SER 61 N -3.55 -0.17 0.00 2.44 0.15 -1.26 -5.19 113.70 106.12 2dno s SER 61 Ca 0.40 0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.12 2dno s SER 61 Cb -0.10 0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.38 2dno s SER 61 CO 0.32 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 175.12 2dno n GLY 62 N 0.12 2.30 3.84 9.45 0.00 -1.26 -5.10 105.19 114.54 2dno n GLY 62 Ca -0.02 -2.07 -0.32 0.00 0.00 0.00 0.00 46.02 43.61 2dno n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dno s SER 63 N -0.89 6.80 -0.12 1.61 0.01 -1.26 -5.00 113.70 114.84 2dno s SER 63 Ca 0.00 1.51 -0.03 0.00 1.31 0.00 0.00 55.95 58.74 2dno s SER 63 Cb 0.00 -2.47 -0.06 0.00 0.21 0.00 0.00 66.02 63.70 2dno s SER 63 CO 0.00 -0.37 -0.14 -1.20 0.41 0.00 0.00 173.24 171.94 2dno n SER 64 N -0.82 1.71 0.00 2.44 7.64 -1.26 -5.13 113.62 118.20 2dno n SER 64 Ca 0.06 0.07 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2dno n SER 64 Cb 0.54 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2dno n SER 64 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dno n GLY 65 N 2.51 1.98 3.29 0.23 0.00 -1.26 -5.03 105.19 106.91 2dno n GLY 65 Ca -0.23 -1.03 -0.45 0.00 0.00 0.00 0.00 46.02 44.31 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 0.00 6.49 -0.30 1.61 1.04 -1.26 -5.00 113.70 116.28 2dno s SER 66 Ca 0.00 -2.71 0.02 0.00 0.48 0.00 0.00 55.95 53.74 2dno s SER 66 Cb 0.00 -2.15 0.09 0.00 0.10 0.00 0.00 66.02 64.06 2dno s SER 66 CO 0.00 -0.54 0.02 -0.60 0.98 0.00 0.00 173.24 173.10 2dno s ARG 67 N 0.14 1.37 0.07 4.02 3.52 -1.26 -4.99 118.95 121.83 2dno s ARG 67 Ca 0.17 -1.41 0.00 0.00 -0.13 0.00 0.00 55.73 54.37 2dno s ARG 67 Cb -0.12 -2.71 0.00 0.00 -1.56 0.00 0.00 34.95 30.55 2dno s ARG 67 CO -0.08 -0.84 0.00 0.41 -0.81 0.00 0.00 175.30 173.98 2dno n GLY 68 N 4.52 -5.34 3.25 8.12 0.00 -1.26 -4.91 105.19 109.58 2dno n GLY 68 Ca -0.03 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 2dno n GLY 68 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dno s GLU 69 N -0.87 3.02 -0.16 1.61 -1.05 -1.26 -5.02 118.70 114.97 2dno s GLU 69 Ca 0.00 -2.15 -0.02 0.00 -0.15 0.00 0.00 54.97 52.65 2dno s GLU 69 Cb 0.00 -4.16 0.05 0.00 -0.44 0.00 0.00 34.13 29.58 2dno s GLU 69 CO 0.00 -1.25 -0.01 -0.51 0.95 0.00 0.00 175.26 174.44 2dno s ASP 70 N 2.32 2.69 -0.01 0.83 1.11 -1.26 -5.02 116.67 117.32 2dno s ASP 70 Ca 0.12 -0.65 -0.26 0.00 0.18 0.00 0.00 52.55 51.94 2dno s ASP 70 Cb -0.20 -0.71 -0.20 0.00 1.07 0.00 0.00 42.92 42.88 2dno s ASP 70 CO -0.04 -0.24 1.30 0.03 1.18 0.00 0.00 175.17 177.40 2dno h ARG 71 N 8.20 -0.01 -6.16 8.23 3.08 -1.94 -3.45 114.38 122.33 2dno h ARG 71 Ca -0.20 0.00 -0.74 0.00 0.07 0.00 0.00 59.98 59.12 2dno h ARG 71 Cb 1.11 0.00 0.04 0.00 0.08 0.00 0.00 29.97 31.21 2dno h ARG 71 CO 0.35 0.43 0.55 1.17 -1.07 0.00 0.00 179.97 181.40 2dno n LYS 72 N -4.88 0.84 -4.36 0.04 4.81 -1.26 -4.33 118.16 109.02 2dno n LYS 72 Ca -0.08 0.31 -0.31 0.00 -0.87 0.00 0.00 58.31 57.35 2dno n LYS 72 Cb 0.23 -1.92 -0.10 0.00 0.02 0.00 0.00 35.03 33.26 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 1.57 3.14 -0.41 3.14 1.43 0.84 -2.68 118.68 125.71 2dno s LEU 73 Ca 0.92 -0.24 -0.16 0.00 -1.03 0.00 0.00 54.13 53.63 2dno s LEU 73 Cb -1.10 -1.86 0.02 0.00 0.03 0.00 0.00 46.19 43.28 2dno s LEU 73 CO 0.58 0.24 0.34 0.12 0.23 0.00 0.00 176.35 177.86 2dno s PHE 74 N -1.10 3.22 0.11 0.29 5.36 0.83 -1.46 117.98 125.22 2dno s PHE 74 Ca 0.19 -0.51 -0.07 0.00 -0.96 0.00 0.00 56.93 55.59 2dno s PHE 74 Cb -0.11 -2.69 -0.06 0.00 -0.34 0.00 0.00 43.02 39.83 2dno s PHE 74 CO 0.11 -0.62 0.38 0.08 -1.46 0.00 0.00 175.22 173.71 2dno s VAL 75 N 1.83 5.14 0.33 3.12 1.01 0.35 -2.18 120.40 130.01 2dno s VAL 75 Ca 0.07 0.21 0.01 0.00 0.00 0.00 0.00 61.98 62.28 2dno s VAL 75 Cb -0.18 -3.62 -0.00 0.00 0.00 0.00 0.00 36.38 32.57 2dno s VAL 75 CO 0.11 0.15 0.42 0.61 0.00 0.00 0.00 175.10 176.39 2dno n GLY 76 N 0.46 2.36 3.31 4.51 0.00 0.21 -1.79 105.19 114.27 2dno n GLY 76 Ca -0.05 -1.68 -0.23 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.57 -6.58 -2.41 1.61 2.81 -0.78 -2.33 117.12 108.87 2dno n MET 77 Ca 0.02 0.84 -0.24 0.00 -1.81 0.00 0.00 57.70 56.51 2dno n MET 77 Cb 0.57 -5.75 0.07 0.00 -0.71 0.00 0.00 33.22 27.40 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 -6.87 3.00 0.41 4.03 1.43 -1.18 -4.68 118.68 114.82 2dno s LEU 78 Ca 0.46 0.15 0.08 0.00 -1.03 0.00 0.00 54.13 53.79 2dno s LEU 78 Cb -0.20 -2.81 -0.03 0.00 0.03 0.00 0.00 46.19 43.18 2dno s LEU 78 CO 0.57 -1.52 0.32 -0.83 0.23 0.00 0.00 176.35 175.12 2dno s GLY 79 N -4.53 2.18 0.00 -3.19 0.00 -1.26 -4.68 107.32 95.83 2dno s GLY 79 Ca 0.61 -1.94 0.27 0.00 0.00 0.00 0.00 44.72 43.66 2dno s GLY 79 CO 0.43 -1.75 1.94 0.28 0.00 0.00 0.00 173.10 173.99 2dno n LYS 80 N -1.45 0.50 -0.11 2.90 4.01 -1.26 -3.73 118.16 119.02 2dno n LYS 80 Ca 0.02 0.03 -0.18 0.00 -0.51 0.00 0.00 58.31 57.66 2dno n LYS 80 Cb 0.62 -1.50 -0.07 0.00 -0.51 0.00 0.00 35.03 33.58 2dno n LYS 80 CO 0.00 0.00 0.00 0.94 -1.11 0.00 0.00 177.40 177.23 2dno n GLN 81 N -1.22 0.55 -1.19 1.97 -0.06 -1.26 -4.83 117.38 111.33 2dno n GLN 81 Ca 0.15 0.34 -0.37 0.00 -2.00 0.00 0.00 57.00 55.12 2dno n GLN 81 Cb 0.19 -1.54 0.05 0.00 -4.06 0.00 0.00 30.24 24.87 2dno n GLN 81 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2dno n GLN 82 N -4.40 0.14 -4.27 3.69 6.02 -1.24 -5.01 117.38 112.30 2dno n GLN 82 Ca -0.31 0.07 -0.18 0.00 -0.01 0.00 0.00 57.00 56.56 2dno n GLN 82 Cb 0.65 -1.43 -0.08 0.00 1.02 0.00 0.00 30.24 30.39 2dno n GLN 82 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2dno s THR 83 N -1.97 0.01 0.57 5.09 -4.23 -1.26 -4.88 115.64 108.97 2dno s THR 83 Ca 0.58 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.37 2dno s THR 83 Cb -0.36 -2.50 0.40 0.00 1.34 0.00 0.00 72.50 71.38 2dno s THR 83 CO 0.65 0.00 1.94 0.44 -0.54 0.00 0.00 174.62 177.12 2dno h ASP 84 N 2.22 0.00 0.28 3.99 5.19 -1.95 -1.74 116.42 124.41 2dno h ASP 84 Ca -0.27 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.13 2dno h ASP 84 Cb 1.24 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.75 2dno h ASP 84 CO 0.40 0.00 -0.13 -0.33 -3.12 0.00 0.00 179.24 176.05 2dno h GLU 85 N 0.00 -0.36 0.13 3.56 5.08 -1.96 -2.45 114.58 118.59 2dno h GLU 85 Ca 0.24 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.63 2dno h GLU 85 Cb 1.12 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 2dno h GLU 85 CO -0.00 -0.01 -0.45 -0.44 -1.00 0.00 0.00 179.01 177.11 2dno h ASP 86 N -0.87 -1.36 -0.98 1.42 3.32 -1.72 0.21 116.42 116.44 2dno h ASP 86 Ca -0.04 0.14 0.22 0.00 0.02 0.00 0.00 57.03 57.38 2dno h ASP 86 Cb 0.51 0.50 -0.12 0.00 0.22 0.00 0.00 39.33 40.44 2dno h ASP 86 CO 0.06 -0.49 0.56 0.58 -1.72 0.00 0.00 179.24 178.23 2dno h VAL 87 N -0.67 0.58 0.61 -1.35 2.07 -1.58 0.82 116.25 116.72 2dno h VAL 87 Ca -0.01 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 2dno h VAL 87 Cb 0.66 -0.08 0.01 0.00 -1.52 0.00 0.00 31.29 30.36 2dno h VAL 87 CO -0.23 0.11 -0.29 -0.09 0.02 0.00 0.00 177.57 177.09 2dno h ARG 88 N 0.60 -0.79 0.00 1.57 2.43 -0.79 0.15 114.38 117.55 2dno h ARG 88 Ca 0.61 0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.83 2dno h ARG 88 Cb 1.09 0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.82 2dno h ARG 88 CO -0.46 -0.52 -0.00 -0.22 -1.51 0.00 0.00 179.97 177.26 2dno h LYS 89 N -1.03 0.00 0.00 0.20 3.64 -0.09 0.26 116.57 119.56 2dno h LYS 89 Ca -0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2dno h LYS 89 Cb 0.62 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2dno h LYS 89 CO 0.14 0.00 -0.74 1.98 -2.27 0.00 0.00 179.45 178.56 2dno h MET 90 N 0.00 0.00 0.00 1.90 4.05 0.79 -3.32 114.93 118.35 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 0.05 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.85 2dno h MET 90 CO 0.00 0.00 -1.13 1.19 0.23 0.00 0.00 176.91 177.21 2dno n PHE 91 N -2.77 0.00 -0.17 1.39 3.01 0.50 -4.39 117.46 115.03 2dno n PHE 91 Ca 0.01 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.37 2dno n PHE 91 Cb 0.54 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.92 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 0.86 0.00 -1.08 5.08 -0.69 -2.81 114.58 115.94 2dno h GLU 92 Ca 0.00 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2dno h GLU 92 Cb 0.55 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2dno h GLU 92 CO 0.00 0.89 0.45 -2.30 -1.00 0.00 0.00 179.01 177.05 2dno n PRO 93 N -4.34 0.06 -0.80 2.33 -0.02 -1.26 0.12 135.00 131.09 2dno n PRO 93 Ca 0.01 0.53 0.01 0.00 -2.02 0.00 0.00 63.50 62.03 2dno n PRO 93 Cb 0.31 -2.15 0.19 0.00 -0.02 0.00 0.00 33.50 31.82 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 -1.94 0.49 0.00 6.00 3.72 -1.06 -5.08 117.46 119.59 2dno n PHE 94 Ca -0.01 -1.61 0.00 0.00 -0.05 0.00 0.00 57.45 55.78 2dno n PHE 94 Cb 0.46 -0.31 0.00 0.00 -0.94 0.00 0.00 39.48 38.69 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 -1.07 1.49 3.80 1.37 0.00 0.32 -4.48 105.19 106.62 2dno n GLY 95 Ca 0.24 -2.13 -0.38 0.00 0.00 0.00 0.00 46.02 43.75 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 -1.30 4.97 -0.21 2.61 2.01 -1.26 -4.06 115.64 118.39 2dno s THR 96 Ca 0.00 0.99 -0.12 0.00 0.31 0.00 0.00 61.69 62.87 2dno s THR 96 Cb 0.00 -3.80 -0.05 0.00 0.01 0.00 0.00 72.50 68.67 2dno s THR 96 CO 0.00 0.52 0.21 -0.63 -0.69 0.00 0.00 174.62 174.03 2dno s ILE 97 N -0.73 5.34 -0.05 1.82 1.01 -1.26 0.11 121.20 127.43 2dno s ILE 97 Ca 0.26 0.33 0.08 0.00 0.00 0.00 0.00 60.65 61.32 2dno s ILE 97 Cb -0.17 -3.55 -0.24 0.00 0.01 0.00 0.00 42.46 38.51 2dno s ILE 97 CO 0.15 0.36 0.64 -0.78 0.00 0.00 0.00 174.94 175.30 2dno h ASP 98 N 7.19 0.10 -5.10 3.58 3.58 -0.91 -3.46 116.42 121.40 2dno h ASP 98 Ca -0.39 -0.20 -0.06 0.00 0.42 0.00 0.00 57.03 56.80 2dno h ASP 98 Cb 1.16 -0.03 -0.13 0.00 1.72 0.00 0.00 39.33 42.05 2dno h ASP 98 CO 0.70 1.18 -0.12 -1.61 -2.88 0.00 0.00 179.24 176.51 2dno s GLU 99 N -2.60 1.05 -0.30 0.28 0.41 -0.91 -5.03 118.70 111.61 2dno s GLU 99 Ca -0.08 -0.77 -0.15 0.00 -0.41 0.00 0.00 54.97 53.56 2dno s GLU 99 Cb 0.08 0.45 0.16 0.00 -1.78 0.00 0.00 34.13 33.04 2dno s GLU 99 CO 0.82 -0.40 0.99 0.00 -0.49 0.00 0.00 175.26 176.17 2dno s THR 101 N 2.05 -0.01 0.03 0.00 2.01 -0.59 -4.99 115.64 114.14 2dno s THR 101 Ca -0.05 0.02 -0.09 0.00 0.31 0.00 0.00 61.69 61.88 2dno s THR 101 Cb -0.05 -0.06 -0.05 0.00 0.01 0.00 0.00 72.50 72.35 2dno s THR 101 CO -0.16 0.01 0.33 -0.69 -0.69 0.00 0.00 174.62 173.42 2dno s VAL 102 N 0.11 5.20 -0.26 3.82 1.01 -1.26 -0.44 120.40 128.57 2dno s VAL 102 Ca -0.01 0.34 -0.12 0.00 0.00 0.00 0.00 61.98 62.19 2dno s VAL 102 Cb -0.01 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.71 2dno s VAL 102 CO -0.00 0.36 0.25 -0.76 0.00 0.00 0.00 175.10 174.94 2dno s LEU 103 N -1.75 4.06 0.35 3.92 1.43 -0.80 -4.96 118.68 120.91 2dno s LEU 103 Ca 0.29 0.13 0.06 0.00 -1.03 0.00 0.00 54.13 53.58 2dno s LEU 103 Cb -0.14 -2.23 -0.07 0.00 0.03 0.00 0.00 46.19 43.79 2dno s LEU 103 CO 0.16 -0.06 0.01 -0.13 0.23 0.00 0.00 176.35 176.56 2dno s ARG 104 N 1.66 1.75 0.73 1.70 0.52 -1.26 -2.68 118.95 121.37 2dno s ARG 104 Ca 0.10 -1.96 -0.01 0.00 -0.52 0.00 0.00 55.73 53.34 2dno s ARG 104 Cb -0.15 -1.25 0.13 0.00 0.52 0.00 0.00 34.95 34.20 2dno s ARG 104 CO 0.09 -0.08 1.01 0.20 0.02 0.00 0.00 175.30 176.54 2dno s GLY 105 N -3.57 1.75 0.30 -3.53 0.00 -1.09 -4.89 107.32 96.30 2dno s GLY 105 Ca 0.34 -1.78 0.05 0.00 0.00 0.00 0.00 44.72 43.33 2dno s GLY 105 CO 0.16 -1.19 1.66 -2.55 0.00 0.00 0.00 173.10 171.17 2dno h PRO 106 N -0.56 0.26 -0.49 2.90 0.11 -2.02 0.16 132.00 132.36 2dno h PRO 106 Ca -0.36 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.65 2dno h PRO 106 Cb 1.26 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 2dno h PRO 106 CO 0.39 0.17 -0.03 -0.44 -0.21 0.00 0.00 178.00 177.88 2dno h ASP 107 N 0.26 0.87 0.00 -2.05 3.32 -2.06 -3.47 116.42 113.30 2dno h ASP 107 Ca 0.59 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 57.32 2dno h ASP 107 Cb 1.21 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.52 2dno h ASP 107 CO -0.62 0.99 0.00 0.61 -1.72 0.00 0.00 179.24 178.49 2dno n GLY 108 N -0.34 1.21 3.75 2.75 0.00 0.56 -5.11 105.19 108.01 2dno n GLY 108 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.00 4.28 -0.09 2.61 2.01 -1.26 -4.72 115.64 116.47 2dno s THR 109 Ca 0.00 1.99 -0.34 0.00 0.31 0.00 0.00 61.69 63.64 2dno s THR 109 Cb 0.00 -4.28 -0.12 0.00 0.01 0.00 0.00 72.50 68.11 2dno s THR 109 CO 0.00 0.45 1.87 -0.24 -0.69 0.00 0.00 174.62 176.00 2dno n SER 110 N 1.94 3.40 0.16 3.53 2.88 -1.26 -2.67 113.62 121.60 2dno n SER 110 Ca -0.02 0.98 0.02 0.00 -1.33 0.00 0.00 58.87 58.53 2dno n SER 110 Cb 0.48 -1.36 0.25 0.00 -0.75 0.00 0.00 64.21 62.82 2dno n SER 110 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2dno h LYS 111 N 9.02 0.00 0.00 -1.46 1.79 -1.85 -3.45 116.57 120.61 2dno h LYS 111 Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 2dno h LYS 111 Cb 1.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.92 2dno h LYS 111 CO 0.95 0.49 0.00 0.41 -1.08 0.00 0.00 179.45 180.22 2dno n GLY 112 N 0.29 1.93 3.48 3.86 0.00 -1.26 -4.96 105.19 108.52 2dno n GLY 112 Ca -0.01 0.00 -0.17 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 -1.01 -0.60 -0.25 0.00 0.00 -0.74 -1.91 121.76 117.25 2dno s ALA 114 Ca -0.10 -0.22 -0.07 0.00 0.00 0.00 0.00 51.96 51.56 2dno s ALA 114 Cb -0.01 0.49 -0.03 0.00 0.00 0.00 0.00 23.12 23.57 2dno s ALA 114 CO 0.08 -0.52 0.07 -0.06 0.00 0.00 0.00 175.76 175.34 2dno s PHE 115 N -3.38 3.09 -0.25 0.00 0.08 0.41 -0.50 117.98 117.43 2dno s PHE 115 Ca 0.01 -0.38 -0.02 0.00 0.12 0.00 0.00 56.93 56.65 2dno s PHE 115 Cb 0.02 -2.24 0.02 0.00 -0.57 0.00 0.00 43.02 40.26 2dno s PHE 115 CO -0.09 -0.33 -0.04 0.08 -0.10 0.00 0.00 175.22 174.74 2dno s VAL 116 N 1.57 3.02 -0.35 -0.44 1.01 -0.54 -1.55 120.40 123.14 2dno s VAL 116 Ca 0.06 -0.98 -0.11 0.00 0.00 0.00 0.00 61.98 60.95 2dno s VAL 116 Cb -0.15 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.69 2dno s VAL 116 CO 0.04 0.18 0.20 -0.75 0.00 0.00 0.00 175.10 174.77 2dno s LYS 117 N 1.35 3.18 0.90 2.72 2.20 -0.01 -0.11 119.74 129.97 2dno s LYS 117 Ca 0.00 -0.84 -0.14 0.00 -0.36 0.00 0.00 55.97 54.63 2dno s LYS 117 Cb -0.17 -3.71 0.15 0.00 -1.51 0.00 0.00 37.83 32.59 2dno s LYS 117 CO -0.03 -0.54 1.26 -0.06 -0.36 0.00 0.00 175.35 175.61 2dno s PHE 118 N 1.63 2.19 0.12 4.03 0.40 -1.26 -0.43 117.98 124.66 2dno s PHE 118 Ca 0.04 0.51 -0.10 0.00 -0.60 0.00 0.00 56.93 56.78 2dno s PHE 118 Cb -0.18 -3.84 -0.12 0.00 0.51 0.00 0.00 43.02 39.39 2dno s PHE 118 CO 0.08 -2.27 1.32 0.37 0.70 0.00 0.00 175.22 175.41 2dno h GLN 119 N -1.39 0.70 -3.73 0.44 4.15 0.43 -3.37 115.11 112.34 2dno h GLN 119 Ca -0.45 -0.59 -0.16 0.00 0.77 0.00 0.00 58.65 58.21 2dno h GLN 119 Cb 1.28 0.13 -0.22 0.00 0.21 0.00 0.00 27.48 28.88 2dno h GLN 119 CO 0.51 1.20 -0.60 0.95 -1.93 0.00 0.00 178.83 178.95 2dno s THR 120 N -3.66 0.08 0.09 2.39 -4.23 -1.26 -5.00 115.64 104.06 2dno s THR 120 Ca -0.09 -0.70 -0.19 0.00 -1.18 0.00 0.00 61.69 59.53 2dno s THR 120 Cb 0.09 -0.31 -0.05 0.00 1.34 0.00 0.00 72.50 73.57 2dno s THR 120 CO 0.89 -0.38 1.32 -0.74 -0.54 0.00 0.00 174.62 175.17 2dno h HIS 121 N 4.68 -1.10 -0.72 3.99 -0.00 -1.94 -1.12 115.15 118.94 2dno h HIS 121 Ca -0.31 0.07 0.07 0.00 -0.00 0.00 0.00 60.37 60.20 2dno h HIS 121 Cb 1.20 0.54 -0.09 0.00 -0.00 0.00 0.00 27.41 29.07 2dno h HIS 121 CO 0.60 -0.24 -0.41 0.00 -0.00 0.00 0.00 177.93 177.87 2dno n ALA 122 N -3.09 -0.43 -0.22 5.26 0.00 -1.26 0.13 120.51 120.90 2dno n ALA 122 Ca 0.00 0.62 0.03 0.00 0.00 0.00 0.00 53.44 54.09 2dno n ALA 122 Cb 0.17 -0.12 0.13 0.00 0.00 0.00 0.00 19.45 19.63 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 0.17 -0.73 0.00 4.39 -1.50 0.48 114.58 117.39 2dno h GLU 123 Ca 0.13 -0.01 0.09 0.00 0.34 0.00 0.00 59.36 59.91 2dno h GLU 123 Cb 0.31 -0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.85 2dno h GLU 123 CO -0.68 0.11 0.39 0.00 -1.16 0.00 0.00 179.01 177.66 2dno h ALA 124 N 1.58 1.02 -0.64 3.43 0.00 0.16 -1.53 119.26 123.28 2dno h ALA 124 Ca 0.36 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.23 2dno h ALA 124 Cb 0.59 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 2dno h ALA 124 CO -0.52 0.01 0.10 0.37 0.00 0.00 0.00 179.25 179.20 2dno h GLN 125 N 0.66 1.04 0.05 0.00 5.75 0.19 -3.20 115.11 119.61 2dno h GLN 125 Ca 0.35 -0.27 0.00 0.00 -0.15 0.00 0.00 58.65 58.59 2dno h GLN 125 Cb 0.34 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 2dno h GLN 125 CO -0.25 0.96 -0.20 0.00 -2.65 0.00 0.00 178.83 176.69 2dno h ALA 126 N 1.12 -0.72 -1.00 3.38 0.00 -0.13 -1.97 119.26 119.95 2dno h ALA 126 Ca 0.20 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.17 2dno h ALA 126 Cb 0.43 0.61 -0.13 0.00 0.00 0.00 0.00 17.79 18.69 2dno h ALA 126 CO 0.01 -0.77 -0.53 0.00 0.00 0.00 0.00 179.25 177.96 2dno n ALA 127 N -2.62 -0.49 -0.14 0.00 0.00 -1.10 -1.22 120.51 114.95 2dno n ALA 127 Ca -0.03 0.89 -0.11 0.00 0.00 0.00 0.00 53.44 54.19 2dno n ALA 127 Cb 0.15 -0.23 -0.08 0.00 0.00 0.00 0.00 19.45 19.29 2dno n ALA 127 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2dno h ILE 128 N 0.00 0.00 -0.77 0.00 2.04 -1.50 1.92 117.51 119.20 2dno h ILE 128 Ca 0.21 0.00 0.28 0.00 1.00 0.00 0.00 64.86 66.36 2dno h ILE 128 Cb 0.46 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.40 2dno h ILE 128 CO -0.95 0.00 0.26 0.59 0.00 0.00 0.00 178.15 178.05 2dno n ASN 129 N -4.90 0.13 0.00 1.72 4.13 -0.35 -1.17 115.26 114.82 2dno n ASN 129 Ca -0.02 1.29 0.00 0.00 1.68 0.00 0.00 54.58 57.53 2dno n ASN 129 Cb 0.27 -0.57 0.00 0.00 -1.54 0.00 0.00 39.78 37.94 2dno n ASN 129 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 2dno n THR 130 N -4.87 0.00 -0.12 3.41 -1.04 0.28 -4.73 114.28 107.20 2dno n THR 130 Ca 0.25 0.31 -0.03 0.00 -2.04 0.00 0.00 64.05 62.54 2dno n THR 130 Cb 0.84 -1.30 -0.03 0.00 -1.82 0.00 0.00 70.33 68.02 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 -2.12 -0.30 -3.41 -4.42 4.77 0.63 -3.75 117.00 108.40 2dno n LEU 131 Ca 0.00 0.94 -0.48 0.00 -0.03 0.00 0.00 56.01 56.44 2dno n LEU 131 Cb 0.00 -0.28 -0.10 0.00 -2.33 0.00 0.00 43.42 40.71 2dno n LEU 131 CO 0.00 -0.63 1.37 1.57 -1.33 0.00 0.00 177.39 178.37 2dno n HIS 132 N -3.58 0.94 -3.50 -1.77 -0.00 -0.32 0.17 115.22 107.17 2dno n HIS 132 Ca 0.01 0.63 -0.19 0.00 0.46 0.00 0.00 57.72 58.62 2dno n HIS 132 Cb 0.07 -1.83 0.08 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 5.90 -3.12 0.00 0.26 2.88 0.32 -4.90 113.62 114.96 2dno n SER 133 Ca 0.43 -0.62 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 2dno n SER 133 Cb -0.03 -5.01 0.00 0.00 -0.75 0.00 0.00 64.21 58.42 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 -3.09 0.00 -3.77 -3.46 2.88 0.45 -4.93 113.62 101.69 2dno n SER 134 Ca -0.21 0.01 -0.12 0.00 -1.33 0.00 0.00 58.87 57.23 2dno n SER 134 Cb 0.64 -0.25 0.04 0.00 -0.75 0.00 0.00 64.21 63.90 2dno n SER 134 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 2dno n ARG 135 N -1.95 0.76 -3.49 -1.46 1.85 -1.26 -4.93 116.66 106.17 2dno n ARG 135 Ca 0.00 -1.88 -0.27 0.00 -1.00 0.00 0.00 57.85 54.70 2dno n ARG 135 Cb 0.00 -0.15 -0.09 0.00 -1.05 0.00 0.00 32.46 31.17 2dno n ARG 135 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2dno n THR 136 N -1.77 0.88 -0.88 8.89 -1.04 -1.26 -1.74 114.28 117.36 2dno n THR 136 Ca 0.10 -4.55 -0.29 0.00 -2.04 0.00 0.00 64.05 57.27 2dno n THR 136 Cb 0.36 -2.01 0.01 0.00 -1.82 0.00 0.00 70.33 66.87 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 1.60 -3.19 -4.66 -4.42 4.77 -1.26 -4.77 117.00 105.07 2dno n LEU 137 Ca 0.25 0.40 -0.43 0.00 -0.03 0.00 0.00 56.01 56.21 2dno n LEU 137 Cb 0.43 -0.62 -0.02 0.00 -2.33 0.00 0.00 43.42 40.88 2dno n LEU 137 CO 0.26 -3.81 1.20 -2.16 -1.33 0.00 0.00 177.39 171.55 2dno s PRO 138 N -0.94 4.22 0.00 3.23 0.04 -1.26 -2.94 135.00 137.35 2dno s PRO 138 Ca 0.39 1.90 0.00 0.00 0.04 0.00 0.00 61.00 63.33 2dno s PRO 138 Cb -0.31 -3.83 0.00 0.00 0.04 0.00 0.00 34.50 30.40 2dno s PRO 138 CO 0.52 -0.74 0.00 0.41 0.04 0.00 0.00 177.00 177.23 2dno n GLY 139 N 3.81 0.92 2.86 0.56 0.00 -1.26 -4.54 105.19 107.54 2dno n GLY 139 Ca 0.15 -0.50 -0.30 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 1.70 0.00 4.61 0.00 -1.15 -4.87 121.76 120.04 2dno s ALA 140 Ca 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.67 2dno s ALA 140 Cb 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 23.12 21.70 2dno s ALA 140 CO 0.00 -1.28 0.42 0.43 0.00 0.00 0.00 175.76 175.33 2dno n SER 141 N 4.77 0.00 -3.27 0.00 7.64 -1.26 -4.55 113.62 116.95 2dno n SER 141 Ca -0.09 0.42 -0.12 0.00 1.01 0.00 0.00 58.87 60.09 2dno n SER 141 Cb 0.44 -0.14 0.07 0.00 -1.01 0.00 0.00 64.21 63.57 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 -1.67 0.62 -4.23 6.43 7.64 -1.26 -5.07 113.62 116.08 2dno n SER 142 Ca 0.00 -1.55 -0.29 0.00 1.01 0.00 0.00 58.87 58.04 2dno n SER 142 Cb 0.00 -0.35 0.20 0.00 -1.01 0.00 0.00 64.21 63.05 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 -3.14 1.92 0.33 6.43 0.01 -1.26 -4.68 113.70 113.31 2dno s SER 143 Ca 0.35 0.80 -0.29 0.00 1.31 0.00 0.00 55.95 58.12 2dno s SER 143 Cb -0.02 -1.20 -0.11 0.00 0.21 0.00 0.00 66.02 64.91 2dno s SER 143 CO 0.23 -3.53 1.51 -0.22 0.41 0.00 0.00 173.24 171.65 2dno s LEU 144 N -6.60 4.34 -0.27 2.44 2.96 -0.71 -4.81 118.68 116.03 2dno s LEU 144 Ca 0.69 2.97 -0.08 0.00 -0.22 0.00 0.00 54.13 57.49 2dno s LEU 144 Cb -0.13 -3.65 -0.02 0.00 0.50 0.00 0.00 46.19 42.90 2dno s LEU 144 CO 0.56 -0.86 0.09 -0.69 -1.32 0.00 0.00 176.35 174.13 2dno s VAL 145 N -0.62 4.33 -0.23 1.68 1.01 -0.99 -0.52 120.40 125.06 2dno s VAL 145 Ca 0.57 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 62.23 2dno s VAL 145 Cb -0.46 -3.10 0.07 0.00 0.00 0.00 0.00 36.38 32.89 2dno s VAL 145 CO 0.55 0.24 0.04 -0.69 0.00 0.00 0.00 175.10 175.24 2dno s VAL 146 N 1.60 0.76 0.02 2.92 1.01 -1.26 0.67 120.40 126.12 2dno s VAL 146 Ca 0.05 -0.90 -0.02 0.00 0.00 0.00 0.00 61.98 61.12 2dno s VAL 146 Cb -0.16 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 34.88 2dno s VAL 146 CO 0.04 -0.34 0.00 -1.59 0.00 0.00 0.00 175.10 173.22 2dno s LYS 147 N 1.73 0.38 0.57 2.72 -2.85 -0.92 -4.53 119.74 116.83 2dno s LYS 147 Ca 0.01 -0.65 -0.18 0.00 -1.00 0.00 0.00 55.97 54.16 2dno s LYS 147 Cb -0.17 0.14 -0.09 0.00 -2.06 0.00 0.00 37.83 35.65 2dno s LYS 147 CO -0.13 -0.07 0.52 1.19 0.10 0.00 0.00 175.35 176.96 2dno n PHE 148 N 1.38 -0.70 -2.88 1.78 3.72 -1.26 -0.12 117.46 119.38 2dno n PHE 148 Ca -0.23 0.44 -0.21 0.00 -0.05 0.00 0.00 57.45 57.40 2dno n PHE 148 Cb 0.56 -1.95 0.09 0.00 -0.94 0.00 0.00 39.48 37.24 2dno n PHE 148 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2dno s ALA 149 N -1.72 4.36 0.54 4.37 0.00 -1.09 -4.44 121.76 123.79 2dno s ALA 149 Ca 0.69 -2.09 0.04 0.00 0.00 0.00 0.00 51.96 50.60 2dno s ALA 149 Cb -0.45 -1.62 0.03 0.00 0.00 0.00 0.00 23.12 21.08 2dno s ALA 149 CO 0.54 -1.20 0.32 0.16 0.00 0.00 0.00 175.76 175.59 2dno s ASP 150 N -4.75 4.52 0.25 0.00 1.47 -1.26 -4.95 116.67 111.95 2dno s ASP 150 Ca 0.65 -1.35 -0.15 0.00 1.18 0.00 0.00 52.55 52.87 2dno s ASP 150 Cb -0.05 0.49 -0.08 0.00 -0.34 0.00 0.00 42.92 42.94 2dno s ASP 150 CO 0.42 -1.07 0.67 -0.89 0.68 0.00 0.00 175.17 174.98 2dno s THR 151 N -2.81 4.71 -0.08 2.11 2.01 -1.26 -5.01 115.64 115.32 2dno s THR 151 Ca 0.27 0.95 -0.25 0.00 0.31 0.00 0.00 61.69 62.97 2dno s THR 151 Cb -0.02 -3.70 -0.21 0.00 0.01 0.00 0.00 72.50 68.58 2dno s THR 151 CO 0.17 0.01 0.96 -0.08 -0.69 0.00 0.00 174.62 174.98 2dno h GLU 152 N 2.83 -0.04 -3.43 4.92 4.57 -2.06 -3.48 114.58 117.89 2dno h GLU 152 Ca -0.48 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 57.66 2dno h GLU 152 Cb 1.18 0.01 -0.12 0.00 -0.16 0.00 0.00 28.75 29.66 2dno h GLU 152 CO 0.66 0.62 -0.07 -1.59 -1.18 0.00 0.00 179.01 177.46 2dno s LYS 153 N -3.21 1.22 -0.32 1.92 0.00 -1.26 -5.11 119.74 112.98 2dno s LYS 153 Ca -0.16 -0.85 -0.28 0.00 0.00 0.00 0.00 55.97 54.68 2dno s LYS 153 Cb -0.00 0.48 -0.03 0.00 0.00 0.00 0.00 37.83 38.28 2dno s LYS 153 CO 0.62 -0.49 1.92 -2.00 0.00 0.00 0.00 175.35 175.40 2dno s GLU 154 N -3.86 3.21 -0.17 1.78 -6.30 -1.26 -4.97 118.70 107.13 2dno s GLU 154 Ca 0.08 1.53 -0.04 0.00 -2.50 0.00 0.00 54.97 54.04 2dno s GLU 154 Cb 0.01 -4.26 -0.03 0.00 0.00 0.00 0.00 34.13 29.85 2dno s GLU 154 CO -0.06 -2.01 -0.02 -1.54 0.02 0.00 0.00 175.26 171.65 2dno s SER 155 N 6.93 4.89 0.00 -1.70 1.04 -1.26 -5.09 113.70 118.51 2dno s SER 155 Ca 0.85 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 57.15 2dno s SER 155 Cb -0.24 -1.81 0.00 0.00 0.10 0.00 0.00 66.02 64.06 2dno s SER 155 CO 0.33 0.14 0.00 0.61 0.98 0.00 0.00 173.24 175.30 2dno n GLY 156 N 3.73 4.13 3.56 7.32 0.00 -1.26 -5.10 105.19 117.57 2dno n GLY 156 Ca -0.17 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 2dno n GLY 156 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dno s PRO 157 N -0.17 3.11 0.41 1.61 0.04 -1.26 -5.00 135.00 133.74 2dno s PRO 157 Ca 0.00 0.11 -0.23 0.00 0.04 0.00 0.00 61.00 60.91 2dno s PRO 157 Cb 0.00 -4.21 -0.09 0.00 0.04 0.00 0.00 34.50 30.24 2dno s PRO 157 CO 0.00 -2.21 1.04 -1.12 0.04 0.00 0.00 177.00 174.75 2dno s SER 158 N 4.78 6.74 -1.59 6.66 0.01 -1.26 -3.54 113.70 125.49 2dno s SER 158 Ca 0.46 2.00 -0.13 0.00 1.31 0.00 0.00 55.95 59.58 2dno s SER 158 Cb -0.10 -2.58 0.11 0.00 0.21 0.00 0.00 66.02 63.66 2dno s SER 158 CO 0.19 -0.50 0.78 -1.20 0.41 0.00 0.00 173.24 172.91 2dno n SER 159 N -0.18 -3.14 0.00 2.44 7.64 -1.26 -5.34 113.62 113.78 2dno n SER 159 Ca 0.05 -0.94 0.00 0.00 1.01 0.00 0.00 58.87 58.99 2dno n SER 159 Cb 0.50 -3.16 0.00 0.00 -1.01 0.00 0.00 64.21 60.54 2dno n SER 159 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64