#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 6.16 -0.27 1.61 1.04 -1.26 -5.03 113.70 115.96 2dno s SER 60 Ca 0.00 -0.96 0.01 0.00 0.48 0.00 0.00 55.95 55.48 2dno s SER 60 Cb 0.00 -2.20 0.08 0.00 0.10 0.00 0.00 66.02 63.99 2dno s SER 60 CO 0.00 -0.60 0.00 -0.94 0.98 0.00 0.00 173.24 172.68 2dno s SER 61 N 2.11 4.02 0.00 7.02 1.04 -1.26 -5.07 113.70 121.55 2dno s SER 61 Ca 0.08 -1.44 0.00 0.00 0.48 0.00 0.00 55.95 55.07 2dno s SER 61 Cb -0.20 -1.17 0.00 0.00 0.10 0.00 0.00 66.02 64.75 2dno s SER 61 CO 0.10 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.63 2dno n GLY 62 N 4.64 3.92 3.79 7.32 0.00 -1.26 -5.14 105.19 118.46 2dno n GLY 62 Ca -0.07 -0.59 -0.34 0.00 0.00 0.00 0.00 46.02 45.02 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 0.00 6.37 -0.29 1.61 0.15 -1.26 -5.06 113.70 115.22 2dno s SER 63 Ca 0.00 1.95 -0.16 0.00 0.70 0.00 0.00 55.95 58.44 2dno s SER 63 Cb 0.00 -2.56 0.14 0.00 -1.71 0.00 0.00 66.02 61.88 2dno s SER 63 CO 0.00 -0.76 0.92 -0.94 1.20 0.00 0.00 173.24 173.66 2dno s SER 64 N -1.92 -0.61 0.00 5.45 1.04 -1.26 -5.14 113.70 111.26 2dno s SER 64 Ca 0.66 0.95 0.00 0.00 0.48 0.00 0.00 55.95 58.04 2dno s SER 64 Cb -0.17 1.35 0.00 0.00 0.10 0.00 0.00 66.02 67.30 2dno s SER 64 CO 0.21 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.89 2dno n GLY 65 N 4.06 2.48 3.79 7.32 0.00 -1.26 -5.17 105.19 116.41 2dno n GLY 65 Ca -0.17 -1.21 -0.08 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.20 0.09 1.61 1.04 -1.26 -5.07 113.70 109.91 2dno s SER 66 Ca 0.00 -0.71 -0.28 0.00 0.48 0.00 0.00 55.95 55.44 2dno s SER 66 Cb 0.00 0.70 -0.15 0.00 0.10 0.00 0.00 66.02 66.67 2dno s SER 66 CO 0.00 -1.32 1.68 0.03 0.98 0.00 0.00 173.24 174.61 2dno h ARG 67 N 2.06 -0.43 0.00 4.02 3.08 -2.02 -3.45 114.38 117.64 2dno h ARG 67 Ca -0.21 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.87 2dno h ARG 67 Cb 1.25 0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.40 2dno h ARG 67 CO 0.27 -0.29 0.00 0.41 -1.07 0.00 0.00 179.97 179.29 2dno n GLY 68 N -1.30 0.12 3.39 0.04 0.00 -1.26 -4.62 105.19 101.56 2dno n GLY 68 Ca -0.09 0.70 -0.35 0.00 0.00 0.00 0.00 46.02 46.28 2dno n GLY 68 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dno s GLU 69 N 0.00 3.52 -1.51 1.61 2.12 -1.26 -4.66 118.70 118.53 2dno s GLU 69 Ca 0.00 -0.56 -0.02 0.00 0.36 0.00 0.00 54.97 54.75 2dno s GLU 69 Cb 0.00 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.32 2dno s GLU 69 CO 0.00 -0.09 0.10 -0.25 -0.54 0.00 0.00 175.26 174.48 2dno n ASP 70 N 4.53 0.44 0.18 -1.70 9.92 -1.26 -4.84 116.55 123.82 2dno n ASP 70 Ca -0.17 -1.25 -0.16 0.00 -0.53 0.00 0.00 54.79 52.68 2dno n ASP 70 Cb 0.51 -1.79 -0.09 0.00 -0.64 0.00 0.00 41.12 39.11 2dno n ASP 70 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2dno h ARG 71 N -1.85 -0.77 -6.01 -1.24 3.08 -1.94 -3.43 114.38 102.21 2dno h ARG 71 Ca -0.66 0.05 -0.64 0.00 0.07 0.00 0.00 59.98 58.80 2dno h ARG 71 Cb 1.40 0.18 0.14 0.00 0.08 0.00 0.00 29.97 31.76 2dno h ARG 71 CO 0.69 -0.52 -0.76 1.17 -1.07 0.00 0.00 179.97 179.48 2dno n LYS 72 N -5.51 0.01 -4.75 0.04 4.81 -1.26 -4.47 118.16 107.04 2dno n LYS 72 Ca -0.09 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.11 2dno n LYS 72 Cb 0.42 -1.01 -0.15 0.00 0.02 0.00 0.00 35.03 34.30 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 3.73 1.98 -0.47 3.14 1.43 0.17 -3.95 118.68 124.72 2dno s LEU 73 Ca 0.61 -0.30 -0.22 0.00 -1.03 0.00 0.00 54.13 53.20 2dno s LEU 73 Cb -0.76 -0.84 0.03 0.00 0.03 0.00 0.00 46.19 44.65 2dno s LEU 73 CO 0.60 0.17 0.73 0.12 0.23 0.00 0.00 176.35 178.21 2dno s PHE 74 N -0.22 3.00 -0.18 0.29 5.36 0.15 -2.17 117.98 124.21 2dno s PHE 74 Ca 0.03 -0.04 -0.10 0.00 -0.96 0.00 0.00 56.93 55.85 2dno s PHE 74 Cb -0.08 -3.59 -0.05 0.00 -0.34 0.00 0.00 43.02 38.97 2dno s PHE 74 CO 0.00 -1.00 0.17 0.08 -1.46 0.00 0.00 175.22 173.01 2dno s VAL 75 N 3.12 5.40 0.39 3.12 1.01 -0.68 -2.08 120.40 130.68 2dno s VAL 75 Ca 0.25 0.27 0.01 0.00 0.00 0.00 0.00 61.98 62.52 2dno s VAL 75 Cb -0.14 -3.50 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 2dno s VAL 75 CO 0.19 0.45 0.05 0.61 0.00 0.00 0.00 175.10 176.41 2dno n GLY 76 N 3.29 3.55 3.54 4.51 0.00 1.00 -1.68 105.19 119.41 2dno n GLY 76 Ca -0.16 -2.24 -0.22 0.00 0.00 0.00 0.00 46.02 43.40 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 -0.95 -7.65 -3.53 1.61 2.81 -0.89 -2.90 117.12 105.64 2dno n MET 77 Ca -0.13 0.82 -0.20 0.00 -1.81 0.00 0.00 57.70 56.38 2dno n MET 77 Cb 0.53 -5.84 -0.01 0.00 -0.71 0.00 0.00 33.22 27.19 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 -7.06 4.02 0.18 4.03 1.43 -0.58 -4.70 118.68 116.01 2dno s LEU 78 Ca 0.47 -0.01 0.08 0.00 -1.03 0.00 0.00 54.13 53.63 2dno s LEU 78 Cb -0.21 -2.87 -0.04 0.00 0.03 0.00 0.00 46.19 43.10 2dno s LEU 78 CO 0.72 -0.37 -0.15 -0.83 0.23 0.00 0.00 176.35 175.95 2dno s GLY 79 N -4.12 1.35 0.21 -3.19 0.00 -1.26 -4.41 107.32 95.89 2dno s GLY 79 Ca 0.42 -1.54 -0.09 0.00 0.00 0.00 0.00 44.72 43.51 2dno s GLY 79 CO 0.32 -1.61 1.76 1.70 0.00 0.00 0.00 173.10 175.27 2dno h LYS 80 N 2.95 0.47 -0.78 2.90 3.11 -1.93 -2.33 116.57 120.96 2dno h LYS 80 Ca -0.40 -0.03 0.14 0.00 -2.81 0.00 0.00 60.65 57.56 2dno h LYS 80 Cb 1.21 -0.11 -0.14 0.00 -1.00 0.00 0.00 32.23 32.19 2dno h LYS 80 CO 0.56 0.31 -0.28 0.37 -2.81 0.00 0.00 179.45 177.60 2dno h GLN 81 N 0.48 -0.05 -6.92 1.90 4.15 -1.96 -3.39 115.11 109.31 2dno h GLN 81 Ca 0.30 0.00 -0.48 0.00 0.77 0.00 0.00 58.65 59.24 2dno h GLN 81 Cb 0.33 0.01 0.01 0.00 0.21 0.00 0.00 27.48 28.04 2dno h GLN 81 CO -0.27 -0.03 0.41 -0.65 -1.93 0.00 0.00 178.83 176.36 2dno s GLN 82 N -6.11 4.32 0.30 1.69 -1.52 -0.88 -5.06 119.66 112.40 2dno s GLN 82 Ca -0.14 1.52 0.02 0.00 -1.95 0.00 0.00 55.36 54.81 2dno s GLN 82 Cb 0.20 -2.68 -0.05 0.00 -0.22 0.00 0.00 33.01 30.26 2dno s GLN 82 CO 0.73 -0.01 0.11 -0.08 -0.25 0.00 0.00 175.29 175.79 2dno s THR 83 N -1.58 0.58 0.36 -0.19 -1.32 -1.26 -4.75 115.64 107.48 2dno s THR 83 Ca 0.54 -2.00 0.18 0.00 -1.21 0.00 0.00 61.69 59.20 2dno s THR 83 Cb -0.23 -2.59 0.35 0.00 -1.51 0.00 0.00 72.50 68.52 2dno s THR 83 CO 0.29 0.00 1.64 -2.24 -2.21 0.00 0.00 174.62 172.10 2dno h ASP 84 N 2.23 0.44 -0.29 8.08 3.04 -1.97 0.42 116.42 128.37 2dno h ASP 84 Ca -0.37 0.20 0.03 0.00 -3.24 0.00 0.00 57.03 53.66 2dno h ASP 84 Cb 1.25 0.17 -0.03 0.00 -1.04 0.00 0.00 39.33 39.67 2dno h ASP 84 CO 0.59 -0.21 0.08 -0.33 -2.04 0.00 0.00 179.24 177.32 2dno h GLU 85 N 0.22 0.19 0.38 4.15 5.08 -1.99 -1.32 114.58 121.29 2dno h GLU 85 Ca 0.77 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 59.10 2dno h GLU 85 Cb 1.91 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 31.12 2dno h GLU 85 CO -0.62 0.13 -0.18 -0.44 -1.00 0.00 0.00 179.01 176.89 2dno h ASP 86 N 0.20 -0.43 -0.98 1.42 3.32 -0.57 -2.27 116.42 117.10 2dno h ASP 86 Ca 0.13 0.01 0.10 0.00 0.02 0.00 0.00 57.03 57.30 2dno h ASP 86 Cb 0.12 0.11 -0.13 0.00 0.22 0.00 0.00 39.33 39.65 2dno h ASP 86 CO -0.15 -0.28 -0.54 0.58 -1.72 0.00 0.00 179.24 177.13 2dno h VAL 87 N -0.57 0.00 -0.13 -1.35 2.07 -1.40 0.82 116.25 115.68 2dno h VAL 87 Ca -0.05 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.49 2dno h VAL 87 Cb 0.39 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.11 2dno h VAL 87 CO 0.09 0.00 -0.44 -0.09 0.02 0.00 0.00 177.57 177.15 2dno h ARG 88 N -0.01 -0.43 -0.01 1.57 2.43 -1.29 0.86 114.38 117.49 2dno h ARG 88 Ca 0.20 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 2dno h ARG 88 Cb 0.46 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.11 2dno h ARG 88 CO -0.94 -0.29 0.04 0.87 -1.51 0.00 0.00 179.97 178.13 2dno h LYS 89 N -0.45 0.00 0.00 0.20 1.57 -0.59 0.39 116.57 117.69 2dno h LYS 89 Ca 0.03 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2dno h LYS 89 Cb 0.54 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 2dno h LYS 89 CO -0.36 0.00 -0.64 1.98 -0.57 0.00 0.00 179.45 179.86 2dno h MET 90 N 0.00 0.00 0.00 3.15 4.05 0.40 -3.31 114.93 119.22 2dno h MET 90 Ca 0.01 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 2dno h MET 90 Cb 0.08 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.88 2dno h MET 90 CO -0.00 0.04 -1.20 1.19 0.23 0.00 0.00 176.91 177.17 2dno n PHE 91 N -2.87 0.00 -0.22 1.39 3.01 0.27 -4.39 117.46 114.64 2dno n PHE 91 Ca 0.01 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.40 2dno n PHE 91 Cb 0.57 -0.13 0.03 0.00 -0.01 0.00 0.00 39.48 39.94 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 0.93 0.00 -1.08 4.39 -0.47 -2.57 114.58 115.79 2dno h GLU 92 Ca 0.00 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.52 2dno h GLU 92 Cb 0.59 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2dno h GLU 92 CO 0.00 0.80 0.44 -2.30 -1.16 0.00 0.00 179.01 176.79 2dno n PRO 93 N -4.43 0.06 -0.79 2.33 -0.02 -1.26 0.12 135.00 131.01 2dno n PRO 93 Ca 0.04 0.51 0.01 0.00 -2.02 0.00 0.00 63.50 62.04 2dno n PRO 93 Cb 0.18 -2.13 0.19 0.00 -0.02 0.00 0.00 33.50 31.72 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 0.48 0.00 6.00 3.72 -0.97 -5.07 117.46 119.73 2dno n PHE 94 Ca -0.01 -1.60 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 1.53 3.83 1.37 0.00 0.32 -4.45 105.19 106.70 2dno n GLY 95 Ca 0.24 -2.17 -0.38 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.33 4.91 -0.17 2.61 2.01 -1.26 -4.05 115.64 118.36 2dno s THR 96 Ca 0.00 0.96 -0.09 0.00 0.31 0.00 0.00 61.69 62.87 2dno s THR 96 Cb 0.00 -3.78 -0.05 0.00 0.01 0.00 0.00 72.50 68.68 2dno s THR 96 CO 0.00 0.52 0.13 -0.63 -0.69 0.00 0.00 174.62 173.96 2dno s ILE 97 N -1.15 5.44 -0.22 1.82 1.01 -1.26 -1.22 121.20 125.63 2dno s ILE 97 Ca 0.28 0.20 -0.06 0.00 0.00 0.00 0.00 60.65 61.06 2dno s ILE 97 Cb -0.17 -3.44 -0.18 0.00 0.01 0.00 0.00 42.46 38.67 2dno s ILE 97 CO 0.16 0.51 -0.06 -0.67 0.00 0.00 0.00 174.94 174.89 2dno n ASP 98 N 2.89 2.00 -4.01 3.58 -0.08 -0.16 -4.86 116.55 115.91 2dno n ASP 98 Ca -0.18 0.12 -0.12 0.00 -1.51 0.00 0.00 54.79 53.10 2dno n ASP 98 Cb 0.53 -0.68 -0.12 0.00 2.34 0.00 0.00 41.12 43.19 2dno n ASP 98 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2dno s GLU 99 N -2.51 0.41 -0.27 -0.67 2.02 -1.13 -5.03 118.70 111.52 2dno s GLU 99 Ca -0.32 -0.55 -0.24 0.00 0.02 0.00 0.00 54.97 53.88 2dno s GLU 99 Cb 0.09 -0.19 0.08 0.00 0.10 0.00 0.00 34.13 34.21 2dno s GLU 99 CO 0.62 0.03 0.75 0.00 0.02 0.00 0.00 175.26 176.68 2dno s THR 101 N 0.53 0.00 0.04 0.00 2.01 -0.65 -5.02 115.64 112.55 2dno s THR 101 Ca -0.01 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 61.95 2dno s THR 101 Cb -0.05 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.41 2dno s THR 101 CO -0.02 0.00 0.25 -0.69 -0.69 0.00 0.00 174.62 173.47 2dno s VAL 102 N 0.02 5.33 -0.18 3.82 1.01 -1.26 -0.36 120.40 128.78 2dno s VAL 102 Ca -0.01 -0.05 -0.09 0.00 0.00 0.00 0.00 61.98 61.84 2dno s VAL 102 Cb -0.04 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.71 2dno s VAL 102 CO 0.00 0.25 0.12 -0.76 0.00 0.00 0.00 175.10 174.71 2dno s LEU 103 N -2.11 4.16 0.35 3.92 1.43 -0.89 -4.96 118.68 120.58 2dno s LEU 103 Ca 0.31 0.25 0.04 0.00 -1.03 0.00 0.00 54.13 53.70 2dno s LEU 103 Cb -0.13 -2.06 -0.06 0.00 0.03 0.00 0.00 46.19 43.98 2dno s LEU 103 CO 0.21 0.23 0.06 -0.13 0.23 0.00 0.00 176.35 176.95 2dno s ARG 104 N 0.05 1.74 0.39 1.70 0.52 -1.26 -2.78 118.95 119.31 2dno s ARG 104 Ca 0.09 -1.99 0.04 0.00 -0.52 0.00 0.00 55.73 53.35 2dno s ARG 104 Cb -0.11 -0.92 0.07 0.00 0.52 0.00 0.00 34.95 34.50 2dno s ARG 104 CO -0.00 -0.23 0.53 0.41 0.02 0.00 0.00 175.30 176.03 2dno n GLY 105 N -0.77 1.58 0.28 -3.53 0.00 -0.91 -4.83 105.19 97.01 2dno n GLY 105 Ca -0.04 -2.13 -0.08 0.00 0.00 0.00 0.00 46.02 43.76 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 -0.23 -0.49 1.61 0.11 -2.02 -2.09 132.00 128.89 2dno h PRO 106 Ca -0.18 0.02 0.10 0.00 0.11 0.00 0.00 66.00 66.05 2dno h PRO 106 Cb 0.77 0.05 -0.10 0.00 0.11 0.00 0.00 31.00 31.83 2dno h PRO 106 CO 0.23 -0.16 -0.21 0.22 -0.21 0.00 0.00 178.00 177.88 2dno h ASP 107 N -0.24 -0.73 0.00 -2.05 1.82 -2.07 -3.45 116.42 109.70 2dno h ASP 107 Ca 0.04 0.17 0.00 0.00 -0.39 0.00 0.00 57.03 56.86 2dno h ASP 107 Cb 0.36 0.40 0.00 0.00 0.68 0.00 0.00 39.33 40.78 2dno h ASP 107 CO -0.37 -0.24 0.00 0.61 -1.61 0.00 0.00 179.24 177.64 2dno n GLY 108 N -1.40 1.05 3.85 -0.78 0.00 -0.78 -5.15 105.19 101.98 2dno n GLY 108 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.09 5.16 -0.75 2.61 2.01 -1.26 -4.84 115.64 117.49 2dno s THR 109 Ca 0.00 -0.20 -0.26 0.00 0.31 0.00 0.00 61.69 61.54 2dno s THR 109 Cb 0.00 -3.37 -0.09 0.00 0.01 0.00 0.00 72.50 69.06 2dno s THR 109 CO 0.00 0.38 2.22 -0.55 -0.69 0.00 0.00 174.62 175.98 2dno s SER 110 N -1.72 4.48 0.32 3.53 0.15 -1.26 -2.13 113.70 117.07 2dno s SER 110 Ca 0.24 0.08 0.17 0.00 0.70 0.00 0.00 55.95 57.14 2dno s SER 110 Cb -0.12 -2.54 1.15 0.00 -1.71 0.00 0.00 66.02 62.80 2dno s SER 110 CO 0.15 -3.22 1.38 0.29 1.20 0.00 0.00 173.24 173.03 2dno n LYS 111 N 8.91 -0.05 0.00 5.44 4.76 -1.12 -4.60 118.16 131.50 2dno n LYS 111 Ca 0.40 1.21 0.00 0.00 -2.87 0.00 0.00 58.31 57.05 2dno n LYS 111 Cb 0.47 -2.16 0.00 0.00 -1.84 0.00 0.00 35.03 31.50 2dno n LYS 111 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dno n GLY 112 N -1.24 1.66 3.50 0.72 0.00 -1.26 -4.94 105.19 103.62 2dno n GLY 112 Ca 0.33 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.04 -0.20 -0.22 0.00 0.00 -0.67 -2.10 121.76 116.53 2dno s ALA 114 Ca -0.06 -0.68 -0.06 0.00 0.00 0.00 0.00 51.96 51.17 2dno s ALA 114 Cb -0.00 0.68 -0.02 0.00 0.00 0.00 0.00 23.12 23.77 2dno s ALA 114 CO 0.01 -0.59 0.02 -0.06 0.00 0.00 0.00 175.76 175.14 2dno s PHE 115 N -3.90 3.05 -0.12 0.00 0.08 0.52 -1.68 117.98 115.92 2dno s PHE 115 Ca 0.10 -0.49 0.03 0.00 0.12 0.00 0.00 56.93 56.69 2dno s PHE 115 Cb 0.04 -2.13 0.00 0.00 -0.57 0.00 0.00 43.02 40.36 2dno s PHE 115 CO -0.06 -0.30 -0.22 0.08 -0.10 0.00 0.00 175.22 174.62 2dno s VAL 116 N 1.22 2.19 -0.15 -0.44 1.01 -0.92 -1.63 120.40 121.67 2dno s VAL 116 Ca 0.04 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.06 2dno s VAL 116 Cb -0.15 -1.86 -0.00 0.00 0.00 0.00 0.00 36.38 34.37 2dno s VAL 116 CO 0.02 0.55 -0.15 -0.75 0.00 0.00 0.00 175.10 174.76 2dno s LYS 117 N 0.52 3.23 0.52 2.72 2.20 0.91 0.46 119.74 130.29 2dno s LYS 117 Ca -0.14 -0.75 -0.00 0.00 -0.36 0.00 0.00 55.97 54.72 2dno s LYS 117 Cb -0.17 -2.61 0.02 0.00 -1.51 0.00 0.00 37.83 33.55 2dno s LYS 117 CO 0.05 0.04 0.75 -0.06 -0.36 0.00 0.00 175.35 175.77 2dno s PHE 118 N 0.76 3.07 0.12 4.03 0.40 -1.26 -0.99 117.98 124.10 2dno s PHE 118 Ca -0.06 0.19 -0.12 0.00 -0.60 0.00 0.00 56.93 56.34 2dno s PHE 118 Cb -0.15 -2.58 -0.11 0.00 0.51 0.00 0.00 43.02 40.69 2dno s PHE 118 CO 0.01 -0.66 1.36 0.37 0.70 0.00 0.00 175.22 176.99 2dno h GLN 119 N 0.16 0.83 -4.36 0.44 5.75 -1.49 -3.41 115.11 113.02 2dno h GLN 119 Ca -0.44 -0.60 -0.34 0.00 -0.15 0.00 0.00 58.65 57.12 2dno h GLN 119 Cb 1.27 0.10 -0.29 0.00 1.07 0.00 0.00 27.48 29.64 2dno h GLN 119 CO 0.56 1.22 -0.76 0.95 -2.65 0.00 0.00 178.83 178.15 2dno s THR 120 N -3.93 0.47 0.18 2.39 -4.23 -1.26 -5.00 115.64 104.26 2dno s THR 120 Ca -0.10 -0.24 -0.26 0.00 -1.18 0.00 0.00 61.69 59.91 2dno s THR 120 Cb 0.09 -0.40 0.05 0.00 1.34 0.00 0.00 72.50 73.58 2dno s THR 120 CO 0.90 0.14 1.55 -0.74 -0.54 0.00 0.00 174.62 175.92 2dno h HIS 121 N 6.07 -1.53 -0.30 3.99 -0.00 -1.87 -1.56 115.15 119.96 2dno h HIS 121 Ca -0.29 0.11 0.03 0.00 -0.00 0.00 0.00 60.37 60.22 2dno h HIS 121 Cb 1.19 0.80 -0.04 0.00 -0.00 0.00 0.00 27.41 29.36 2dno h HIS 121 CO 0.41 -0.39 -0.17 0.00 -0.00 0.00 0.00 177.93 177.77 2dno n ALA 122 N -3.31 -0.19 -0.19 5.26 0.00 -1.26 -0.14 120.51 120.67 2dno n ALA 122 Ca 0.05 0.25 -0.04 0.00 0.00 0.00 0.00 53.44 53.69 2dno n ALA 122 Cb 0.32 0.20 0.02 0.00 0.00 0.00 0.00 19.45 20.00 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 -0.13 -0.73 0.00 5.08 -1.56 0.01 114.58 117.24 2dno h GLU 123 Ca 0.05 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.56 2dno h GLU 123 Cb 0.12 0.03 -0.14 0.00 0.50 0.00 0.00 28.75 29.26 2dno h GLU 123 CO -0.28 -0.09 -0.19 0.00 -1.00 0.00 0.00 179.01 177.46 2dno h ALA 124 N 1.13 0.48 -0.23 3.43 0.00 -0.15 0.19 119.26 124.10 2dno h ALA 124 Ca 0.24 0.29 -0.01 0.00 0.00 0.00 0.00 54.91 55.43 2dno h ALA 124 Cb 0.53 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2dno h ALA 124 CO -0.65 -0.42 0.11 0.37 0.00 0.00 0.00 179.25 178.67 2dno h GLN 125 N -0.00 0.33 -0.62 0.00 -0.00 0.17 -2.97 115.11 112.02 2dno h GLN 125 Ca 0.35 -0.05 0.12 0.00 -0.00 0.00 0.00 58.65 59.08 2dno h GLN 125 Cb 0.54 -0.06 -0.12 0.00 0.00 0.00 0.00 27.48 27.84 2dno h GLN 125 CO -0.76 0.33 -0.20 0.00 0.00 0.00 0.00 178.83 178.21 2dno h ALA 126 N 0.98 0.31 0.34 3.38 0.00 0.30 0.97 119.26 125.55 2dno h ALA 126 Ca 0.08 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 2dno h ALA 126 Cb 0.11 0.55 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2dno h ALA 126 CO -0.01 -0.48 -0.49 0.00 0.00 0.00 0.00 179.25 178.27 2dno h ALA 127 N 1.49 -1.02 -0.25 0.00 0.00 -1.19 -2.84 119.26 115.44 2dno h ALA 127 Ca 0.29 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.11 2dno h ALA 127 Cb 0.49 0.75 -0.07 0.00 0.00 0.00 0.00 17.79 18.96 2dno h ALA 127 CO -0.66 -1.12 -0.21 0.82 0.00 0.00 0.00 179.25 178.07 2dno h ILE 128 N -0.88 0.44 -0.75 0.00 2.04 -1.22 0.91 117.51 118.05 2dno h ILE 128 Ca -0.03 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.12 2dno h ILE 128 Cb 0.81 0.44 -0.14 0.00 -0.74 0.00 0.00 36.82 37.19 2dno h ILE 128 CO -0.15 0.00 0.33 -3.20 0.00 0.00 0.00 178.15 175.14 2dno n ASN 129 N -5.36 0.20 -0.01 1.72 5.15 0.26 -0.41 115.26 116.82 2dno n ASN 129 Ca -0.01 1.25 -0.01 0.00 -0.60 0.00 0.00 54.58 55.21 2dno n ASN 129 Cb 0.27 -0.58 -0.00 0.00 -0.53 0.00 0.00 39.78 38.94 2dno n ASN 129 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2dno n THR 130 N -4.76 0.32 -0.31 -0.44 -1.04 -0.53 -4.68 114.28 102.84 2dno n THR 130 Ca 0.27 0.32 0.04 0.00 -2.04 0.00 0.00 64.05 62.64 2dno n THR 130 Cb 0.90 -1.53 0.10 0.00 -1.82 0.00 0.00 70.33 67.98 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 -2.87 -0.35 -4.42 -4.42 4.77 0.30 -3.88 117.00 106.12 2dno n LEU 131 Ca -0.02 1.46 -0.61 0.00 -0.03 0.00 0.00 56.01 56.81 2dno n LEU 131 Cb 0.08 -0.42 -0.11 0.00 -2.33 0.00 0.00 43.42 40.64 2dno n LEU 131 CO 0.03 -1.38 1.56 1.57 -1.33 0.00 0.00 177.39 177.84 2dno n HIS 132 N -5.35 1.40 -3.86 -1.77 -0.00 0.46 0.81 115.22 106.91 2dno n HIS 132 Ca 0.13 0.81 -0.26 0.00 0.46 0.00 0.00 57.72 58.86 2dno n HIS 132 Cb 0.41 -2.31 0.02 0.00 -0.12 0.00 0.00 29.99 27.99 2dno n HIS 132 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 2dno n SER 133 N 6.69 -2.32 0.00 0.26 7.64 0.44 -4.90 113.62 121.43 2dno n SER 133 Ca 0.46 -0.86 0.00 0.00 1.01 0.00 0.00 58.87 59.48 2dno n SER 133 Cb -0.01 -3.70 0.00 0.00 -1.01 0.00 0.00 64.21 59.48 2dno n SER 133 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dno n SER 134 N -2.94 0.00 -5.03 6.43 2.88 0.24 -4.84 113.62 110.36 2dno n SER 134 Ca -0.16 0.06 -0.19 0.00 -1.33 0.00 0.00 58.87 57.25 2dno n SER 134 Cb 0.62 -0.26 0.05 0.00 -0.75 0.00 0.00 64.21 63.86 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 -0.52 2.46 -0.51 -1.46 1.70 -1.26 -4.87 118.95 114.49 2dno s ARG 135 Ca 0.00 -1.52 0.04 0.00 -0.47 0.00 0.00 55.73 53.78 2dno s ARG 135 Cb 0.00 -2.68 0.16 0.00 -0.57 0.00 0.00 34.95 31.86 2dno s ARG 135 CO 0.00 -0.69 0.37 0.99 -1.08 0.00 0.00 175.30 174.89 2dno s THR 136 N -2.58 1.37 0.23 4.99 2.01 -1.26 -0.18 115.64 120.22 2dno s THR 136 Ca 0.60 -3.15 -0.21 0.00 0.31 0.00 0.00 61.69 59.24 2dno s THR 136 Cb -0.07 -1.92 -0.13 0.00 0.01 0.00 0.00 72.50 70.38 2dno s THR 136 CO 0.37 -1.09 0.28 0.18 -0.69 0.00 0.00 174.62 173.67 2dno n LEU 137 N 2.71 -1.55 -4.62 4.42 4.77 -1.26 -4.62 117.00 116.84 2dno n LEU 137 Ca 0.22 0.82 -0.57 0.00 -0.03 0.00 0.00 56.01 56.45 2dno n LEU 137 Cb 0.41 -0.75 -0.08 0.00 -2.33 0.00 0.00 43.42 40.67 2dno n LEU 137 CO 0.17 -2.84 1.45 -2.65 -1.33 0.00 0.00 177.39 172.19 2dno n PRO 138 N 0.93 0.96 -2.11 3.23 -0.02 -1.26 -2.09 135.00 134.63 2dno n PRO 138 Ca 0.12 0.33 -0.02 0.00 -2.02 0.00 0.00 63.50 61.91 2dno n PRO 138 Cb 0.25 -2.08 0.01 0.00 -0.02 0.00 0.00 33.50 31.67 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 4.95 0.39 2.66 -1.23 0.00 -1.26 -4.85 105.19 105.85 2dno n GLY 139 Ca 0.32 -0.34 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.05 0.70 0.00 4.61 0.00 -0.89 -4.87 121.76 118.25 2dno s ALA 140 Ca 0.02 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.44 2dno s ALA 140 Cb -0.00 -1.12 0.00 0.00 0.00 0.00 0.00 23.12 21.99 2dno s ALA 140 CO 0.11 -1.21 0.43 0.45 0.00 0.00 0.00 175.76 175.54 2dno n SER 141 N 5.17 0.00 -5.02 0.00 2.88 -1.26 -4.56 113.62 110.83 2dno n SER 141 Ca -0.08 0.43 -0.18 0.00 -1.33 0.00 0.00 58.87 57.72 2dno n SER 141 Cb 0.48 -0.13 0.03 0.00 -0.75 0.00 0.00 64.21 63.83 2dno n SER 141 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dno s SER 142 N -2.34 5.48 1.42 -3.46 0.15 -1.26 -5.11 113.70 108.59 2dno s SER 142 Ca 0.00 -0.56 -0.23 0.00 0.70 0.00 0.00 55.95 55.86 2dno s SER 142 Cb 0.00 -0.35 0.36 0.00 -1.71 0.00 0.00 66.02 64.32 2dno s SER 142 CO 0.00 -0.95 0.93 -1.20 1.20 0.00 0.00 173.24 173.22 2dno n SER 143 N -1.97 -3.62 -4.55 5.45 7.64 -1.26 -4.79 113.62 110.51 2dno n SER 143 Ca 0.10 -0.96 -0.33 0.00 1.01 0.00 0.00 58.87 58.70 2dno n SER 143 Cb 0.60 -0.99 -0.04 0.00 -1.01 0.00 0.00 64.21 62.77 2dno n SER 143 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2dno s LEU 144 N 0.00 3.26 -0.70 -3.43 2.96 0.75 -4.70 118.68 116.82 2dno s LEU 144 Ca 0.68 0.40 -0.26 0.00 -0.22 0.00 0.00 54.13 54.73 2dno s LEU 144 Cb -0.10 -2.53 -0.02 0.00 0.50 0.00 0.00 46.19 44.04 2dno s LEU 144 CO 0.56 -2.76 1.82 -0.69 -1.32 0.00 0.00 176.35 173.96 2dno s VAL 145 N 10.86 3.42 -0.31 1.68 1.01 -1.14 -0.42 120.40 135.50 2dno s VAL 145 Ca 0.80 0.05 -0.07 0.00 0.00 0.00 0.00 61.98 62.76 2dno s VAL 145 Cb -0.13 -4.07 0.02 0.00 0.00 0.00 0.00 36.38 32.20 2dno s VAL 145 CO 0.18 -1.03 0.10 -0.69 0.00 0.00 0.00 175.10 173.66 2dno s VAL 146 N 8.92 3.98 0.03 2.92 1.01 -1.26 -0.00 120.40 136.01 2dno s VAL 146 Ca 0.65 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 61.69 2dno s VAL 146 Cb -0.10 -3.11 0.02 0.00 0.00 0.00 0.00 36.38 33.19 2dno s VAL 146 CO 0.14 -0.00 0.30 -1.59 0.00 0.00 0.00 175.10 173.95 2dno s LYS 147 N 1.48 0.78 0.22 2.72 -2.85 -0.88 -4.60 119.74 116.62 2dno s LYS 147 Ca 0.02 -0.46 -0.32 0.00 -1.00 0.00 0.00 55.97 54.20 2dno s LYS 147 Cb -0.18 0.34 -0.12 0.00 -2.06 0.00 0.00 37.83 35.81 2dno s LYS 147 CO 0.03 -0.24 1.64 1.19 0.10 0.00 0.00 175.35 178.06 2dno n PHE 148 N 0.69 2.63 -0.82 1.78 3.01 -1.26 0.32 117.46 123.81 2dno n PHE 148 Ca -0.19 0.17 -0.34 0.00 1.01 0.00 0.00 57.45 58.10 2dno n PHE 148 Cb 0.59 -2.61 0.11 0.00 -0.01 0.00 0.00 39.48 37.56 2dno n PHE 148 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2dno n ALA 149 N 3.23 -3.80 -0.03 4.37 0.00 -1.25 -4.59 120.51 118.45 2dno n ALA 149 Ca 0.14 -0.87 -0.04 0.00 0.00 0.00 0.00 53.44 52.67 2dno n ALA 149 Cb 0.34 -1.52 -0.01 0.00 0.00 0.00 0.00 19.45 18.25 2dno n ALA 149 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2dno n ASP 150 N -0.17 1.22 -4.40 0.00 8.00 -1.26 -4.92 116.55 115.02 2dno n ASP 150 Ca 0.03 0.19 -0.32 0.00 0.71 0.00 0.00 54.79 55.40 2dno n ASP 150 Cb 0.58 -0.52 0.16 0.00 -0.02 0.00 0.00 41.12 41.32 2dno n ASP 150 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2dno n THR 151 N -3.70 0.00 -4.06 -3.53 -2.24 -1.26 -5.04 114.28 94.45 2dno n THR 151 Ca -0.07 -0.24 -0.09 0.00 -2.27 0.00 0.00 64.05 61.39 2dno n THR 151 Cb 0.24 -0.70 -0.10 0.00 -2.10 0.00 0.00 70.33 67.67 2dno n THR 151 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2dno s GLU 152 N -3.76 0.52 -0.67 -0.78 2.12 -1.26 -5.11 118.70 109.76 2dno s GLU 152 Ca 0.59 -0.98 0.04 0.00 0.36 0.00 0.00 54.97 54.97 2dno s GLU 152 Cb -0.19 0.09 0.16 0.00 0.26 0.00 0.00 34.13 34.46 2dno s GLU 152 CO 0.66 -0.07 0.46 0.21 -0.54 0.00 0.00 175.26 175.98 2dno s LYS 153 N -2.86 2.43 0.02 4.30 2.20 -1.26 -5.08 119.74 119.49 2dno s LYS 153 Ca -0.02 -3.11 -0.30 0.00 -0.36 0.00 0.00 55.97 52.18 2dno s LYS 153 Cb -0.00 -3.47 -0.04 0.00 -1.51 0.00 0.00 37.83 32.81 2dno s LYS 153 CO -0.05 -1.23 1.00 -1.21 -0.36 0.00 0.00 175.35 173.49 2dno s GLU 154 N -1.07 4.56 -0.24 4.03 2.02 -1.26 -5.03 118.70 121.72 2dno s GLU 154 Ca 0.23 1.45 -0.07 0.00 0.02 0.00 0.00 54.97 56.60 2dno s GLU 154 Cb -0.11 -3.44 -0.03 0.00 0.10 0.00 0.00 34.13 30.65 2dno s GLU 154 CO -0.11 -0.04 0.07 -1.54 0.02 0.00 0.00 175.26 173.66 2dno s SER 155 N 0.89 5.22 0.00 -0.19 1.04 -1.26 -4.97 113.70 114.43 2dno s SER 155 Ca 0.52 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.79 2dno s SER 155 Cb -0.22 -1.93 0.00 0.00 0.10 0.00 0.00 66.02 63.97 2dno s SER 155 CO 0.28 -0.00 0.00 0.61 0.98 0.00 0.00 173.24 175.11 2dno n GLY 156 N 4.72 1.86 3.59 7.32 0.00 -1.26 -4.95 105.19 116.48 2dno n GLY 156 Ca -0.16 -1.61 -0.43 0.00 0.00 0.00 0.00 46.02 43.82 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 -4.66 3.57 0.01 1.61 0.04 -1.26 -4.77 135.00 129.53 2dno s PRO 157 Ca 0.00 0.44 0.00 0.00 0.04 0.00 0.00 61.00 61.48 2dno s PRO 157 Cb 0.00 -3.99 0.00 0.00 0.04 0.00 0.00 34.50 30.55 2dno s PRO 157 CO 0.00 -1.59 0.00 0.45 0.04 0.00 0.00 177.00 175.90 2dno n SER 158 N 8.38 0.04 -4.76 6.66 2.88 -1.26 -5.06 113.62 120.49 2dno n SER 158 Ca 0.11 0.01 -0.41 0.00 -1.33 0.00 0.00 58.87 57.25 2dno n SER 158 Cb 0.49 -0.01 -0.01 0.00 -0.75 0.00 0.00 64.21 63.93 2dno n SER 158 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dno s SER 159 N -5.03 6.57 0.00 -3.46 1.04 -1.26 -5.30 113.70 106.25 2dno s SER 159 Ca 0.00 2.83 0.00 0.00 0.48 0.00 0.00 55.95 59.26 2dno s SER 159 Cb 0.00 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.47 2dno s SER 159 CO 0.00 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.11