#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 -0.20 0.05 1.61 0.01 -1.26 -5.17 113.70 108.73 2dno s SER 60 Ca 0.00 0.18 0.04 0.00 1.31 0.00 0.00 55.95 57.49 2dno s SER 60 Cb 0.00 0.38 -0.02 0.00 0.21 0.00 0.00 66.02 66.59 2dno s SER 60 CO 0.00 -0.37 -0.13 -0.44 0.41 0.00 0.00 173.24 172.71 2dno s SER 61 N -1.00 1.51 0.00 2.44 0.01 -1.26 -5.11 113.70 110.28 2dno s SER 61 Ca -0.11 -0.49 0.00 0.00 1.31 0.00 0.00 55.95 56.66 2dno s SER 61 Cb -0.05 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.11 2dno s SER 61 CO 0.03 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.27 2dno n GLY 62 N 1.75 -0.76 0.15 3.44 0.00 -1.26 -5.05 105.19 103.46 2dno n GLY 62 Ca -0.19 0.87 -0.14 0.00 0.00 0.00 0.00 46.02 46.56 2dno n GLY 62 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dno h SER 63 N 0.00 0.51 -6.73 1.61 4.64 -2.07 -3.47 113.55 108.03 2dno h SER 63 Ca 0.00 -0.56 -0.55 0.00 -0.47 0.00 0.00 61.79 60.21 2dno h SER 63 Cb 0.00 -0.15 -0.17 0.00 -0.31 0.00 0.00 62.40 61.78 2dno h SER 63 CO 0.00 0.98 -0.87 -0.24 -0.87 0.00 0.00 176.83 175.82 2dno n SER 64 N -4.39 -1.65 -3.54 4.97 2.88 -1.26 -4.92 113.62 105.70 2dno n SER 64 Ca -0.07 -1.06 -0.15 0.00 -1.33 0.00 0.00 58.87 56.26 2dno n SER 64 Cb 0.47 -2.64 -0.06 0.00 -0.75 0.00 0.00 64.21 61.23 2dno n SER 64 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dno s GLY 65 N -3.80 -0.46 -0.14 0.46 0.00 -1.26 -5.08 107.32 97.05 2dno s GLY 65 Ca 0.40 1.61 -0.07 0.00 0.00 0.00 0.00 44.72 46.66 2dno s GLY 65 CO 0.93 1.00 -0.18 -1.14 0.00 0.00 0.00 173.10 173.71 2dno n SER 66 N 0.87 1.00 0.03 1.64 3.41 -1.26 -4.96 113.62 114.34 2dno n SER 66 Ca -0.16 0.17 -0.01 0.00 -0.26 0.00 0.00 58.87 58.62 2dno n SER 66 Cb 0.57 -0.41 -0.00 0.00 -0.26 0.00 0.00 64.21 64.11 2dno n SER 66 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2dno n ARG 67 N -3.64 0.03 0.00 4.33 0.63 -1.26 -5.15 116.66 111.61 2dno n ARG 67 Ca -0.27 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.67 2dno n ARG 67 Cb 0.68 -0.55 0.00 0.00 0.45 0.00 0.00 32.46 33.04 2dno n ARG 67 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2dno n GLY 68 N 3.28 0.93 2.72 5.14 0.00 -1.26 -5.13 105.19 110.88 2dno n GLY 68 Ca -0.01 0.42 -0.28 0.00 0.00 0.00 0.00 46.02 46.15 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 2.72 0.62 1.38 1.61 2.02 -1.26 -4.95 118.70 120.84 2dno s GLU 69 Ca 0.00 -0.57 -0.20 0.00 0.02 0.00 0.00 54.97 54.22 2dno s GLU 69 Cb 0.00 -2.00 0.35 0.00 0.10 0.00 0.00 34.13 32.57 2dno s GLU 69 CO 0.00 -0.75 0.88 -0.40 0.02 0.00 0.00 175.26 175.02 2dno n ASP 70 N 5.03 -3.40 0.00 -0.19 5.68 -1.26 -4.91 116.55 117.49 2dno n ASP 70 Ca -0.07 -0.64 0.00 0.00 -0.50 0.00 0.00 54.79 53.58 2dno n ASP 70 Cb 0.46 -1.07 0.00 0.00 -1.14 0.00 0.00 41.12 39.36 2dno n ASP 70 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2dno n ARG 71 N -5.38 0.00 -1.68 0.11 1.74 -1.26 -4.65 116.66 105.54 2dno n ARG 71 Ca 0.09 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.77 2dno n ARG 71 Cb 0.58 -0.28 0.02 0.00 -1.02 0.00 0.00 32.46 31.75 2dno n ARG 71 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2dno n LYS 72 N -2.61 1.73 -4.40 5.56 4.81 -1.26 -4.07 118.16 117.92 2dno n LYS 72 Ca 0.00 0.62 -0.24 0.00 -0.87 0.00 0.00 58.31 57.82 2dno n LYS 72 Cb 0.21 -2.32 -0.11 0.00 0.02 0.00 0.00 35.03 32.83 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 -1.63 2.47 -0.32 3.14 1.43 0.73 -2.46 118.68 122.03 2dno s LEU 73 Ca 0.63 -0.90 -0.08 0.00 -1.03 0.00 0.00 54.13 52.76 2dno s LEU 73 Cb -0.50 -1.03 0.02 0.00 0.03 0.00 0.00 46.19 44.71 2dno s LEU 73 CO 0.56 0.05 0.11 0.12 0.23 0.00 0.00 176.35 177.42 2dno s PHE 74 N -1.98 3.19 -0.09 0.29 2.19 0.11 -1.86 117.98 119.83 2dno s PHE 74 Ca 0.21 -1.06 -0.03 0.00 0.33 0.00 0.00 56.93 56.37 2dno s PHE 74 Cb -0.06 -2.30 -0.04 0.00 -1.31 0.00 0.00 43.02 39.31 2dno s PHE 74 CO 0.09 -0.62 0.05 0.08 1.83 0.00 0.00 175.22 176.66 2dno s VAL 75 N 1.49 4.75 0.06 3.12 1.01 -0.46 -1.47 120.40 128.90 2dno s VAL 75 Ca 0.02 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 61.90 2dno s VAL 75 Cb -0.18 -3.03 -0.00 0.00 0.00 0.00 0.00 36.38 33.16 2dno s VAL 75 CO 0.04 0.59 0.03 0.61 0.00 0.00 0.00 175.10 176.37 2dno n GLY 76 N 2.03 3.95 2.93 4.51 0.00 0.57 -1.77 105.19 117.40 2dno n GLY 76 Ca -0.19 -1.91 -0.21 0.00 0.00 0.00 0.00 46.02 43.71 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 -0.14 -3.78 -2.73 1.61 2.81 -1.15 -3.03 117.12 110.70 2dno n MET 77 Ca -0.01 0.80 -0.26 0.00 -1.81 0.00 0.00 57.70 56.42 2dno n MET 77 Cb 0.10 -5.57 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 -6.43 3.61 0.23 4.03 1.43 -1.22 -4.67 118.68 115.66 2dno s LEU 78 Ca 0.24 0.74 0.11 0.00 -1.03 0.00 0.00 54.13 54.19 2dno s LEU 78 Cb -0.11 -3.65 -0.05 0.00 0.03 0.00 0.00 46.19 42.41 2dno s LEU 78 CO 0.30 -0.65 -0.19 -0.83 0.23 0.00 0.00 176.35 175.21 2dno s GLY 79 N -4.15 1.69 0.19 -3.19 0.00 -1.26 -4.56 107.32 96.04 2dno s GLY 79 Ca 0.48 -1.74 -0.14 0.00 0.00 0.00 0.00 44.72 43.32 2dno s GLY 79 CO 0.43 -1.81 1.68 0.50 0.00 0.00 0.00 173.10 173.90 2dno h LYS 80 N 2.64 0.11 -0.50 2.90 1.57 -1.92 -1.90 116.57 119.48 2dno h LYS 80 Ca -0.41 -0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.46 2dno h LYS 80 Cb 1.23 -0.03 -0.10 0.00 0.08 0.00 0.00 32.23 33.42 2dno h LYS 80 CO 0.57 0.07 -0.23 1.96 -0.57 0.00 0.00 179.45 181.25 2dno h GLN 81 N 0.12 -0.12 -6.59 3.15 1.08 -1.96 -3.40 115.11 107.39 2dno h GLN 81 Ca 0.25 0.01 -0.52 0.00 -1.45 0.00 0.00 58.65 56.94 2dno h GLN 81 Cb 0.38 0.03 0.04 0.00 -0.05 0.00 0.00 27.48 27.88 2dno h GLN 81 CO -0.42 -0.08 0.89 -0.65 -0.95 0.00 0.00 178.83 177.63 2dno s GLN 82 N -6.12 4.21 0.36 1.46 -1.52 -0.71 -5.01 119.66 112.33 2dno s GLN 82 Ca -0.14 2.36 0.04 0.00 -1.95 0.00 0.00 55.36 55.67 2dno s GLN 82 Cb 0.16 -3.19 -0.06 0.00 -0.22 0.00 0.00 33.01 29.70 2dno s GLN 82 CO 0.71 -0.62 0.05 -0.08 -0.25 0.00 0.00 175.29 175.09 2dno s THR 83 N 1.27 1.33 0.25 -0.19 -1.32 -1.26 -4.71 115.64 111.01 2dno s THR 83 Ca 0.70 -2.00 -0.01 0.00 -1.21 0.00 0.00 61.69 59.18 2dno s THR 83 Cb -0.44 -2.79 0.36 0.00 -1.51 0.00 0.00 72.50 68.12 2dno s THR 83 CO 0.31 0.00 1.29 0.47 -2.21 0.00 0.00 174.62 174.48 2dno n ASP 84 N -0.82 -0.15 0.04 8.08 8.00 -1.26 0.72 116.55 131.16 2dno n ASP 84 Ca -0.04 1.41 -0.11 0.00 0.71 0.00 0.00 54.79 56.76 2dno n ASP 84 Cb 0.67 -0.49 -0.04 0.00 -0.02 0.00 0.00 41.12 41.24 2dno n ASP 84 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2dno h GLU 85 N 0.00 -0.35 0.00 -1.24 5.08 -1.97 -0.14 114.58 115.96 2dno h GLU 85 Ca 0.47 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.85 2dno h GLU 85 Cb 0.91 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2dno h GLU 85 CO -0.80 -0.23 0.00 -0.25 -1.00 0.00 0.00 179.01 176.73 2dno n ASP 86 N -5.37 0.00 -0.33 1.42 8.00 0.22 -0.46 116.55 120.04 2dno n ASP 86 Ca -0.04 0.96 -0.10 0.00 0.71 0.00 0.00 54.79 56.32 2dno n ASP 86 Cb 0.28 -0.46 -0.07 0.00 -0.02 0.00 0.00 41.12 40.85 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 0.01 -0.07 2.53 2.07 -1.42 0.95 116.25 120.32 2dno h VAL 87 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2dno h VAL 87 Cb 0.00 0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 29.74 2dno h VAL 87 CO 0.00 0.00 -0.34 -0.09 0.02 0.00 0.00 177.57 177.16 2dno h ARG 88 N -0.12 -0.36 -0.06 1.57 2.43 -0.93 1.34 114.38 118.26 2dno h ARG 88 Ca 0.17 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.38 2dno h ARG 88 Cb 0.49 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2dno h ARG 88 CO -0.84 -0.24 0.12 -0.22 -1.51 0.00 0.00 179.97 177.28 2dno h LYS 89 N -0.37 0.00 0.00 0.20 3.64 0.08 0.83 116.57 120.96 2dno h LYS 89 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2dno h LYS 89 Cb 0.43 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2dno h LYS 89 CO -0.27 0.00 -0.78 1.98 -2.27 0.00 0.00 179.45 178.11 2dno h MET 90 N 0.00 0.00 0.00 1.90 4.05 0.38 -3.33 114.93 117.92 2dno h MET 90 Ca 0.03 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 2dno h MET 90 Cb 0.26 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.06 2dno h MET 90 CO -0.00 0.00 -1.26 1.19 0.23 0.00 0.00 176.91 177.07 2dno n PHE 91 N -2.72 0.00 -0.21 1.39 3.01 0.43 -4.43 117.46 114.93 2dno n PHE 91 Ca 0.01 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.39 2dno n PHE 91 Cb 0.54 -0.18 0.02 0.00 -0.01 0.00 0.00 39.48 39.85 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 0.91 0.00 -1.08 5.08 0.39 -2.64 114.58 117.25 2dno h GLU 92 Ca 0.00 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2dno h GLU 92 Cb 0.59 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2dno h GLU 92 CO 0.00 0.83 0.45 -1.35 -1.00 0.00 0.00 179.01 177.94 2dno h PRO 93 N 0.83 0.00 -0.13 2.33 0.11 -1.78 0.91 132.00 134.27 2dno h PRO 93 Ca 0.19 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.21 2dno h PRO 93 Cb 0.30 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.35 2dno h PRO 93 CO -0.00 0.00 -0.47 1.19 -0.21 0.00 0.00 178.00 178.50 2dno n PHE 94 N -1.99 0.45 0.00 0.65 3.72 -0.99 -5.07 117.46 114.23 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 0.47 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 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 2.40 3.67 1.37 0.00 0.32 -4.45 105.19 107.42 2dno n GLY 95 Ca 0.24 -1.97 -0.38 0.00 0.00 0.00 0.00 46.02 43.91 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 -1.73 5.25 0.04 2.61 2.01 -1.26 -4.06 115.64 118.49 2dno s THR 96 Ca 0.00 0.57 -0.23 0.00 0.31 0.00 0.00 61.69 62.34 2dno s THR 96 Cb 0.00 -3.67 -0.06 0.00 0.01 0.00 0.00 72.50 68.79 2dno s THR 96 CO 0.00 0.28 0.69 -0.63 -0.69 0.00 0.00 174.62 174.27 2dno s ILE 97 N 1.19 4.76 -0.21 1.82 1.01 -1.26 0.15 121.20 128.66 2dno s ILE 97 Ca 0.16 1.46 -0.05 0.00 0.00 0.00 0.00 60.65 62.23 2dno s ILE 97 Cb -0.14 -4.03 -0.20 0.00 0.01 0.00 0.00 42.46 38.10 2dno s ILE 97 CO 0.07 0.42 0.01 -0.67 0.00 0.00 0.00 174.94 174.77 2dno n ASP 98 N 2.55 2.02 -3.73 3.58 -0.08 -0.18 -4.87 116.55 115.84 2dno n ASP 98 Ca -0.05 0.08 -0.13 0.00 -1.51 0.00 0.00 54.79 53.18 2dno n ASP 98 Cb 0.50 -0.66 -0.14 0.00 2.34 0.00 0.00 41.12 43.17 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 -2.52 0.16 -0.08 -0.67 0.41 -1.25 -5.03 118.70 109.71 2dno s GLU 99 Ca -0.30 0.48 -0.01 0.00 -0.41 0.00 0.00 54.97 54.73 2dno s GLU 99 Cb 0.08 -0.14 0.03 0.00 -1.78 0.00 0.00 34.13 32.32 2dno s GLU 99 CO 0.65 -0.17 -0.02 0.00 -0.49 0.00 0.00 175.26 175.23 2dno s THR 101 N 1.85 0.50 -0.12 0.00 2.01 -0.72 -5.02 115.64 114.14 2dno s THR 101 Ca 0.04 -0.18 -0.07 0.00 0.31 0.00 0.00 61.69 61.79 2dno s THR 101 Cb -0.12 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.86 2dno s THR 101 CO -0.06 0.18 0.13 -0.69 -0.69 0.00 0.00 174.62 173.50 2dno s VAL 102 N 0.43 5.44 0.15 3.82 1.01 -1.26 -0.48 120.40 129.51 2dno s VAL 102 Ca -0.05 0.19 -0.24 0.00 0.00 0.00 0.00 61.98 61.87 2dno s VAL 102 Cb -0.09 -3.37 -0.08 0.00 0.00 0.00 0.00 36.38 32.84 2dno s VAL 102 CO -0.00 0.61 0.74 -0.76 0.00 0.00 0.00 175.10 175.69 2dno s LEU 103 N -0.97 4.58 0.18 3.92 1.43 -0.74 -4.98 118.68 122.10 2dno s LEU 103 Ca 0.15 1.58 -0.08 0.00 -1.03 0.00 0.00 54.13 54.75 2dno s LEU 103 Cb -0.12 -3.23 -0.02 0.00 0.03 0.00 0.00 46.19 42.86 2dno s LEU 103 CO 0.04 0.22 0.27 -0.13 0.23 0.00 0.00 176.35 176.98 2dno s ARG 104 N -1.11 1.21 0.72 1.70 0.52 -1.26 -3.12 118.95 117.60 2dno s ARG 104 Ca 0.35 -1.29 -0.03 0.00 -0.52 0.00 0.00 55.73 54.24 2dno s ARG 104 Cb -0.22 0.36 0.15 0.00 0.52 0.00 0.00 34.95 35.76 2dno s ARG 104 CO 0.25 -0.44 0.98 0.41 0.02 0.00 0.00 175.30 176.52 2dno n GLY 105 N -0.24 0.32 0.30 -3.53 0.00 -1.10 -4.87 105.19 96.06 2dno n GLY 105 Ca -0.05 -1.98 -0.02 0.00 0.00 0.00 0.00 46.02 43.98 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 -0.06 -0.79 1.61 0.11 -2.03 0.45 132.00 131.30 2dno h PRO 106 Ca -0.32 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.74 2dno h PRO 106 Cb 1.13 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 2dno h PRO 106 CO 0.32 -0.04 0.31 -0.44 -0.21 0.00 0.00 178.00 177.94 2dno h ASP 107 N -0.06 1.10 0.00 -2.05 3.32 -2.07 -3.47 116.42 113.19 2dno h ASP 107 Ca 0.30 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2dno h ASP 107 Cb 0.53 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.80 2dno h ASP 107 CO -0.72 0.98 0.00 0.61 -1.72 0.00 0.00 179.24 178.39 2dno n GLY 108 N -0.86 1.11 3.74 2.75 0.00 0.15 -5.13 105.19 106.95 2dno n GLY 108 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 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 5.13 -0.84 2.61 2.01 -1.26 -4.82 115.64 116.47 2dno s THR 109 Ca 0.00 0.08 -0.25 0.00 0.31 0.00 0.00 61.69 61.83 2dno s THR 109 Cb 0.00 -3.28 -0.17 0.00 0.01 0.00 0.00 72.50 69.06 2dno s THR 109 CO 0.00 0.52 2.33 -0.24 -0.69 0.00 0.00 174.62 176.54 2dno n SER 110 N 2.88 1.49 -0.55 3.53 2.88 -1.26 -2.72 113.62 119.87 2dno n SER 110 Ca -0.18 -1.61 0.46 0.00 -1.33 0.00 0.00 58.87 56.21 2dno n SER 110 Cb 0.53 -1.60 0.75 0.00 -0.75 0.00 0.00 64.21 63.15 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 12.38 0.00 0.00 -1.46 1.57 -1.89 -3.43 116.57 123.73 2dno h LYS 111 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2dno h LYS 111 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.32 2dno h LYS 111 CO 1.04 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 180.33 2dno n GLY 112 N -1.86 1.30 3.55 3.86 0.00 -1.26 -4.99 105.19 105.78 2dno n GLY 112 Ca 0.37 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.29 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 -1.90 -1.44 -0.21 0.00 0.00 -0.73 -1.79 121.76 115.68 2dno s ALA 114 Ca 0.00 0.51 -0.07 0.00 0.00 0.00 0.00 51.96 52.41 2dno s ALA 114 Cb -0.01 0.65 -0.03 0.00 0.00 0.00 0.00 23.12 23.73 2dno s ALA 114 CO -0.02 -0.65 0.05 -0.06 0.00 0.00 0.00 175.76 175.09 2dno s PHE 115 N -3.19 3.13 -0.17 0.00 0.08 0.37 -1.35 117.98 116.85 2dno s PHE 115 Ca -0.01 -0.23 0.01 0.00 0.12 0.00 0.00 56.93 56.81 2dno s PHE 115 Cb -0.00 -2.14 0.01 0.00 -0.57 0.00 0.00 43.02 40.32 2dno s PHE 115 CO -0.08 -0.13 -0.17 0.08 -0.10 0.00 0.00 175.22 174.81 2dno s VAL 116 N 0.99 2.37 -0.19 -0.44 1.01 -0.78 -1.76 120.40 121.59 2dno s VAL 116 Ca 0.03 -0.86 -0.08 0.00 0.00 0.00 0.00 61.98 61.08 2dno s VAL 116 Cb -0.14 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 2dno s VAL 116 CO 0.03 0.52 0.08 -0.75 0.00 0.00 0.00 175.10 174.98 2dno s LYS 117 N 1.06 4.04 0.32 2.72 2.20 -0.01 -0.20 119.74 129.87 2dno s LYS 117 Ca -0.01 -0.31 0.05 0.00 -0.36 0.00 0.00 55.97 55.34 2dno s LYS 117 Cb -0.14 -3.28 -0.02 0.00 -1.51 0.00 0.00 37.83 32.88 2dno s LYS 117 CO -0.06 0.27 0.46 -0.06 -0.36 0.00 0.00 175.35 175.61 2dno s PHE 118 N 0.39 3.28 0.16 4.03 0.40 -1.26 -1.01 117.98 123.97 2dno s PHE 118 Ca 0.05 -0.05 -0.13 0.00 -0.60 0.00 0.00 56.93 56.20 2dno s PHE 118 Cb -0.12 -1.88 0.05 0.00 0.51 0.00 0.00 43.02 41.59 2dno s PHE 118 CO -0.00 0.12 1.73 0.37 0.70 0.00 0.00 175.22 178.13 2dno h GLN 119 N 0.92 0.80 -3.74 0.44 4.15 0.11 -3.42 115.11 114.37 2dno h GLN 119 Ca -0.48 -0.14 -0.23 0.00 0.77 0.00 0.00 58.65 58.57 2dno h GLN 119 Cb 1.24 -0.13 -0.28 0.00 0.21 0.00 0.00 27.48 28.52 2dno h GLN 119 CO 0.57 0.69 -0.72 0.95 -1.93 0.00 0.00 178.83 178.39 2dno s THR 120 N -5.60 0.01 0.17 2.39 -4.23 -1.26 -5.05 115.64 102.07 2dno s THR 120 Ca -0.13 -0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.09 2dno s THR 120 Cb 0.12 -0.02 -0.01 0.00 1.34 0.00 0.00 72.50 73.93 2dno s THR 120 CO 0.78 0.00 1.54 -0.74 -0.54 0.00 0.00 174.62 175.67 2dno h HIS 121 N 6.15 -1.70 -0.83 3.99 -0.00 -1.85 0.20 115.15 121.12 2dno h HIS 121 Ca -0.24 0.12 0.17 0.00 -0.00 0.00 0.00 60.37 60.42 2dno h HIS 121 Cb 1.21 0.87 -0.16 0.00 -0.00 0.00 0.00 27.41 29.33 2dno h HIS 121 CO 0.41 -0.39 -0.17 0.00 -0.00 0.00 0.00 177.93 177.78 2dno n ALA 122 N -3.27 0.23 0.12 5.26 0.00 -1.26 0.57 120.51 122.16 2dno n ALA 122 Ca 0.03 0.91 -0.13 0.00 0.00 0.00 0.00 53.44 54.25 2dno n ALA 122 Cb 0.30 -0.56 -0.06 0.00 0.00 0.00 0.00 19.45 19.13 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 -0.35 -0.64 0.00 4.39 -0.89 -2.62 114.58 114.48 2dno h GLU 123 Ca 0.41 0.02 0.10 0.00 0.34 0.00 0.00 59.36 60.23 2dno h GLU 123 Cb 0.66 0.08 -0.11 0.00 -0.10 0.00 0.00 28.75 29.28 2dno h GLU 123 CO -0.84 -0.23 -0.41 0.00 -1.16 0.00 0.00 179.01 176.37 2dno h ALA 124 N 0.45 -0.22 -0.69 3.43 0.00 0.38 0.12 119.26 122.73 2dno h ALA 124 Ca 0.01 0.14 0.13 0.00 0.00 0.00 0.00 54.91 55.19 2dno h ALA 124 Cb 0.36 0.94 -0.09 0.00 0.00 0.00 0.00 17.79 18.99 2dno h ALA 124 CO -0.07 -0.78 0.23 0.37 0.00 0.00 0.00 179.25 179.01 2dno h GLN 125 N -0.18 0.36 -0.84 0.00 -0.00 -1.24 -0.33 115.11 112.88 2dno h GLN 125 Ca 0.21 -0.02 0.14 0.00 -0.00 0.00 0.00 58.65 58.98 2dno h GLN 125 Cb 0.56 -0.08 -0.09 0.00 0.00 0.00 0.00 27.48 27.87 2dno h GLN 125 CO -0.73 0.24 0.43 0.00 0.00 0.00 0.00 178.83 178.77 2dno h ALA 126 N 1.52 1.25 0.78 3.38 0.00 -0.41 -0.59 119.26 125.19 2dno h ALA 126 Ca 0.37 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.33 2dno h ALA 126 Cb 0.56 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.34 2dno h ALA 126 CO -0.40 -0.08 -0.37 0.00 0.00 0.00 0.00 179.25 178.40 2dno h ALA 127 N 1.54 -1.04 -0.14 0.00 0.00 -0.46 -3.17 119.26 115.99 2dno h ALA 127 Ca 0.45 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 55.16 2dno h ALA 127 Cb 0.61 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 2dno h ALA 127 CO -0.35 -1.01 -0.45 0.82 0.00 0.00 0.00 179.25 178.26 2dno h ILE 128 N -1.19 0.11 -0.96 0.00 2.04 -1.07 1.46 117.51 117.90 2dno h ILE 128 Ca -0.11 0.00 0.38 0.00 1.00 0.00 0.00 64.86 66.13 2dno h ILE 128 Cb 0.82 0.11 -0.14 0.00 -0.74 0.00 0.00 36.82 36.86 2dno h ILE 128 CO 0.18 0.00 0.56 -3.20 0.00 0.00 0.00 178.15 175.68 2dno n ASN 129 N -5.44 0.26 0.00 1.72 5.15 -0.26 -0.11 115.26 116.58 2dno n ASN 129 Ca -0.04 1.34 0.00 0.00 -0.60 0.00 0.00 54.58 55.28 2dno n ASN 129 Cb 0.37 -0.66 0.00 0.00 -0.53 0.00 0.00 39.78 38.96 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 0.00 -0.35 -0.44 -1.04 -0.15 -4.67 114.28 102.87 2dno n THR 130 Ca 0.33 0.39 0.01 0.00 -2.04 0.00 0.00 64.05 62.74 2dno n THR 130 Cb 1.18 -1.38 0.06 0.00 -1.82 0.00 0.00 70.33 68.37 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 -2.35 -0.52 -3.44 -4.42 4.77 0.48 -4.08 117.00 107.44 2dno n LEU 131 Ca 0.00 1.59 -0.48 0.00 -0.03 0.00 0.00 56.01 57.09 2dno n LEU 131 Cb 0.00 -0.40 -0.07 0.00 -2.33 0.00 0.00 43.42 40.62 2dno n LEU 131 CO 0.00 -1.46 0.75 1.57 -1.33 0.00 0.00 177.39 176.93 2dno n HIS 132 N -5.39 1.12 -4.17 -1.77 -0.00 0.85 0.84 115.22 106.70 2dno n HIS 132 Ca 0.11 0.83 -0.30 0.00 0.46 0.00 0.00 57.72 58.81 2dno n HIS 132 Cb 0.39 -1.61 -0.08 0.00 -0.12 0.00 0.00 29.99 28.57 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 2.54 0.36 0.00 0.26 7.64 0.27 -4.87 113.62 119.82 2dno n SER 133 Ca 0.21 -1.19 0.00 0.00 1.01 0.00 0.00 58.87 58.90 2dno n SER 133 Cb -0.02 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 61.71 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 -2.56 0.00 -5.00 6.43 2.88 0.25 -4.87 113.62 110.75 2dno n SER 134 Ca -0.28 0.07 -0.20 0.00 -1.33 0.00 0.00 58.87 57.13 2dno n SER 134 Cb 0.63 -0.29 0.07 0.00 -0.75 0.00 0.00 64.21 63.87 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 -0.57 2.25 -0.51 -1.46 1.70 -1.26 -4.87 118.95 114.24 2dno s ARG 135 Ca 0.00 -1.59 0.05 0.00 -0.47 0.00 0.00 55.73 53.72 2dno s ARG 135 Cb 0.00 -2.62 0.19 0.00 -0.57 0.00 0.00 34.95 31.95 2dno s ARG 135 CO 0.00 -0.91 0.46 2.41 -1.08 0.00 0.00 175.30 176.18 2dno n THR 136 N -2.29 -0.01 -1.09 4.99 -1.04 -1.26 0.24 114.28 113.81 2dno n THR 136 Ca 0.16 -4.09 -0.36 0.00 -2.04 0.00 0.00 64.05 57.71 2dno n THR 136 Cb 0.61 -1.89 -0.01 0.00 -1.82 0.00 0.00 70.33 67.22 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 2.15 -1.73 -4.66 -4.42 4.77 -1.26 -4.65 117.00 107.19 2dno n LEU 137 Ca 0.26 0.78 -0.57 0.00 -0.03 0.00 0.00 56.01 56.45 2dno n LEU 137 Cb 0.45 -0.74 -0.07 0.00 -2.33 0.00 0.00 43.42 40.73 2dno n LEU 137 CO 0.18 -2.96 1.10 -2.65 -1.33 0.00 0.00 177.39 171.74 2dno n PRO 138 N 0.96 0.96 -2.62 3.23 -0.02 -1.26 -2.32 135.00 133.93 2dno n PRO 138 Ca 0.12 0.35 -0.09 0.00 -2.02 0.00 0.00 63.50 61.86 2dno n PRO 138 Cb 0.27 -1.99 0.04 0.00 -0.02 0.00 0.00 33.50 31.80 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 3.38 -0.09 2.62 -1.23 0.00 -1.26 -4.82 105.19 103.79 2dno n GLY 139 Ca 0.24 -0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.20 0.39 0.00 4.61 0.00 -0.98 -4.89 121.76 117.69 2dno s ALA 140 Ca 0.11 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.85 2dno s ALA 140 Cb -0.01 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 22.14 2dno s ALA 140 CO 0.40 -1.06 0.44 0.43 0.00 0.00 0.00 175.76 175.97 2dno n SER 141 N 5.28 0.00 -3.54 0.00 7.64 -1.26 -4.62 113.62 117.13 2dno n SER 141 Ca -0.06 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 63.60 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 -1.57 1.11 -4.87 6.43 7.64 -1.26 -5.11 113.62 115.99 2dno n SER 142 Ca 0.00 -1.80 -0.31 0.00 1.01 0.00 0.00 58.87 57.77 2dno n SER 142 Cb 0.00 -0.22 0.01 0.00 -1.01 0.00 0.00 64.21 62.99 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 -2.88 6.15 -0.48 6.43 0.01 -1.26 -4.73 113.70 116.95 2dno s SER 143 Ca 0.32 1.37 -0.43 0.00 1.31 0.00 0.00 55.95 58.51 2dno s SER 143 Cb -0.03 -2.41 -0.18 0.00 0.21 0.00 0.00 66.02 63.62 2dno s SER 143 CO 0.20 -0.91 2.04 -0.11 0.41 0.00 0.00 173.24 174.87 2dno n LEU 144 N -2.76 1.04 -4.45 2.44 7.94 0.14 -4.52 117.00 116.83 2dno n LEU 144 Ca 0.06 0.76 -0.43 0.00 -1.11 0.00 0.00 56.01 55.28 2dno n LEU 144 Cb 0.54 -0.94 -0.04 0.00 0.53 0.00 0.00 43.42 43.51 2dno n LEU 144 CO 0.58 -0.76 0.79 -0.69 -1.11 0.00 0.00 177.39 176.19 2dno s VAL 145 N 5.52 4.42 -0.21 1.96 1.01 -1.17 0.95 120.40 132.89 2dno s VAL 145 Ca 1.15 -0.64 -0.08 0.00 0.00 0.00 0.00 61.98 62.42 2dno s VAL 145 Cb -1.42 -4.70 -0.04 0.00 0.00 0.00 0.00 36.38 30.23 2dno s VAL 145 CO 0.67 -1.46 0.09 -0.69 0.00 0.00 0.00 175.10 173.71 2dno s VAL 146 N 3.74 4.87 0.36 2.92 1.01 -1.26 -0.31 120.40 131.72 2dno s VAL 146 Ca 0.24 0.00 -0.03 0.00 0.00 0.00 0.00 61.98 62.19 2dno s VAL 146 Cb -0.15 -3.23 0.01 0.00 0.00 0.00 0.00 36.38 33.02 2dno s VAL 146 CO 0.06 0.42 0.52 -1.59 0.00 0.00 0.00 175.10 174.50 2dno s LYS 147 N 0.70 1.99 0.52 2.72 -2.85 -0.54 -4.60 119.74 117.68 2dno s LYS 147 Ca 0.05 -1.76 -0.10 0.00 -1.00 0.00 0.00 55.97 53.16 2dno s LYS 147 Cb -0.13 0.47 -0.05 0.00 -2.06 0.00 0.00 37.83 36.06 2dno s LYS 147 CO 0.02 -0.84 0.90 -0.06 0.10 0.00 0.00 175.35 175.47 2dno s PHE 148 N -2.88 3.56 0.43 1.78 0.40 -1.26 0.08 117.98 120.09 2dno s PHE 148 Ca 0.29 1.13 0.08 0.00 -0.60 0.00 0.00 56.93 57.83 2dno s PHE 148 Cb -0.01 -2.55 0.00 0.00 0.51 0.00 0.00 43.02 40.97 2dno s PHE 148 CO 0.20 -0.41 0.50 0.00 0.70 0.00 0.00 175.22 176.21 2dno s ALA 149 N -2.82 4.36 -1.23 5.36 0.00 -1.03 -4.08 121.76 122.32 2dno s ALA 149 Ca 0.53 -1.77 -0.02 0.00 0.00 0.00 0.00 51.96 50.69 2dno s ALA 149 Cb -0.10 -1.36 0.00 0.00 0.00 0.00 0.00 23.12 21.66 2dno s ALA 149 CO 0.44 -0.29 0.26 -0.25 0.00 0.00 0.00 175.76 175.92 2dno n ASP 150 N -1.75 -4.83 -4.68 0.00 8.00 -1.26 -4.97 116.55 107.05 2dno n ASP 150 Ca 0.06 -0.13 -0.37 0.00 0.71 0.00 0.00 54.79 55.07 2dno n ASP 150 Cb 0.60 -3.80 -0.08 0.00 -0.02 0.00 0.00 41.12 37.82 2dno n ASP 150 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2dno s THR 151 N -2.91 5.29 0.01 -3.53 -1.32 -1.26 -5.08 115.64 106.84 2dno s THR 151 Ca 0.13 0.45 0.03 0.00 -1.21 0.00 0.00 61.69 61.08 2dno s THR 151 Cb -0.06 -3.61 -0.01 0.00 -1.51 0.00 0.00 72.50 67.32 2dno s THR 151 CO 0.16 0.33 -0.09 -1.61 -2.21 0.00 0.00 174.62 171.20 2dno s GLU 152 N 0.98 0.66 -0.63 7.08 2.02 -1.26 -5.05 118.70 122.51 2dno s GLU 152 Ca 0.13 -0.42 -0.00 0.00 0.02 0.00 0.00 54.97 54.71 2dno s GLU 152 Cb -0.14 -0.61 0.43 0.00 0.10 0.00 0.00 34.13 33.91 2dno s GLU 152 CO 0.05 0.16 1.86 0.36 0.02 0.00 0.00 175.26 177.71 2dno n LYS 153 N 2.54 2.89 -2.41 1.61 2.85 -1.26 -5.00 118.16 119.38 2dno n LYS 153 Ca -0.15 -3.53 -0.42 0.00 -1.05 0.00 0.00 58.31 53.16 2dno n LYS 153 Cb 0.57 -2.28 -0.03 0.00 -0.65 0.00 0.00 35.03 32.63 2dno n LYS 153 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 2dno s GLU 154 N -3.82 4.44 -0.30 -1.58 -1.05 -1.26 -5.01 118.70 110.12 2dno s GLU 154 Ca 0.60 1.78 -0.15 0.00 -0.15 0.00 0.00 54.97 57.05 2dno s GLU 154 Cb 0.48 -3.34 0.15 0.00 -0.44 0.00 0.00 34.13 30.98 2dno s GLU 154 CO -0.08 -0.24 0.94 -1.12 0.95 0.00 0.00 175.26 175.70 2dno s SER 155 N 0.98 -0.62 0.00 0.83 0.01 -1.26 -5.17 113.70 108.47 2dno s SER 155 Ca 0.58 0.91 -0.01 0.00 1.31 0.00 0.00 55.95 58.74 2dno s SER 155 Cb -0.30 1.55 -0.04 0.00 0.21 0.00 0.00 66.02 67.44 2dno s SER 155 CO 0.30 -0.13 0.11 -0.83 0.41 0.00 0.00 173.24 173.10 2dno s GLY 156 N 2.07 2.07 -0.26 3.44 0.00 -1.26 -5.07 107.32 108.31 2dno s GLY 156 Ca -0.05 -0.85 -0.29 0.00 0.00 0.00 0.00 44.72 43.52 2dno s GLY 156 CO -0.17 -0.74 1.20 2.56 0.00 0.00 0.00 173.10 175.95 2dno s PRO 157 N -1.87 4.09 -0.96 2.90 0.04 -1.26 -4.98 135.00 132.96 2dno s PRO 157 Ca 0.25 1.33 -0.12 0.00 0.04 0.00 0.00 61.00 62.50 2dno s PRO 157 Cb -0.12 -3.78 0.24 0.00 0.04 0.00 0.00 34.50 30.88 2dno s PRO 157 CO 0.16 -0.88 0.94 0.45 0.04 0.00 0.00 177.00 177.71 2dno s SER 158 N 2.05 7.00 0.04 6.66 0.15 -1.26 -5.03 113.70 123.32 2dno s SER 158 Ca 0.51 -3.06 -0.32 0.00 0.70 0.00 0.00 55.95 53.78 2dno s SER 158 Cb -0.17 -2.22 -0.11 0.00 -1.71 0.00 0.00 66.02 61.82 2dno s SER 158 CO 0.16 -0.47 1.88 -1.20 1.20 0.00 0.00 173.24 174.82 2dno n SER 159 N 3.55 3.87 0.00 5.45 7.64 -1.26 -5.37 113.62 127.49 2dno n SER 159 Ca 0.19 0.96 0.00 0.00 1.01 0.00 0.00 58.87 61.03 2dno n SER 159 Cb 0.44 -1.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.15 2dno n SER 159 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64