#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 1.09 0.09 1.61 0.01 -1.26 -5.16 113.70 110.08 2dno s SER 60 Ca 0.00 -0.73 0.05 0.00 1.31 0.00 0.00 55.95 56.58 2dno s SER 60 Cb 0.00 0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.23 2dno s SER 60 CO 0.00 -0.28 -0.00 -0.94 0.41 0.00 0.00 173.24 172.43 2dno s SER 61 N -2.16 5.00 -0.96 2.44 1.04 -1.26 -5.07 113.70 112.74 2dno s SER 61 Ca -0.01 -0.19 -0.03 0.00 0.48 0.00 0.00 55.95 56.21 2dno s SER 61 Cb -0.04 -1.18 0.26 0.00 0.10 0.00 0.00 66.02 65.16 2dno s SER 61 CO -0.01 0.17 1.06 0.61 0.98 0.00 0.00 173.24 176.05 2dno n GLY 62 N 0.54 4.56 3.10 7.32 0.00 -1.26 -5.06 105.19 114.40 2dno n GLY 62 Ca -0.11 -2.64 -0.29 0.00 0.00 0.00 0.00 46.02 42.98 2dno n GLY 62 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dno n SER 63 N 1.87 -2.67 -3.77 1.61 3.41 -1.26 -5.04 113.62 107.76 2dno n SER 63 Ca 0.25 -0.15 -0.10 0.00 -0.26 0.00 0.00 58.87 58.60 2dno n SER 63 Cb 0.37 -0.75 -0.05 0.00 -0.26 0.00 0.00 64.21 63.52 2dno n SER 63 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dno s SER 64 N -1.58 0.14 0.00 4.04 0.01 -1.26 -5.12 113.70 109.93 2dno s SER 64 Ca 0.42 -1.08 0.00 0.00 1.31 0.00 0.00 55.95 56.60 2dno s SER 64 Cb -0.03 0.61 0.00 0.00 0.21 0.00 0.00 66.02 66.81 2dno s SER 64 CO 0.54 -1.20 0.00 0.61 0.41 0.00 0.00 173.24 173.60 2dno n GLY 65 N -0.43 0.50 3.47 3.44 0.00 -1.26 -5.16 105.19 105.75 2dno n GLY 65 Ca -0.01 -0.89 -0.09 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.14 0.01 1.61 1.04 -1.26 -5.09 113.70 109.88 2dno s SER 66 Ca 0.00 -0.67 -0.01 0.00 0.48 0.00 0.00 55.95 55.75 2dno s SER 66 Cb 0.00 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 2dno s SER 66 CO 0.00 -1.01 -0.03 0.54 0.98 0.00 0.00 173.24 173.72 2dno n ARG 67 N -0.30 0.05 -2.69 4.02 3.00 -1.26 -4.97 116.66 114.51 2dno n ARG 67 Ca -0.08 0.02 -0.05 0.00 -0.01 0.00 0.00 57.85 57.73 2dno n ARG 67 Cb 0.62 -0.58 0.12 0.00 0.00 0.00 0.00 32.46 32.62 2dno n ARG 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2dno n GLY 68 N 3.03 1.57 3.66 -0.13 0.00 -1.26 -5.11 105.19 106.95 2dno n GLY 68 Ca -0.03 -0.14 -0.52 0.00 0.00 0.00 0.00 46.02 45.33 2dno n GLY 68 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2dno n GLU 69 N -0.94 1.69 -2.73 1.61 0.28 -1.26 -4.95 120.64 114.33 2dno n GLU 69 Ca -0.09 0.60 -0.24 0.00 -0.16 0.00 0.00 57.16 57.28 2dno n GLU 69 Cb 0.86 -2.45 0.02 0.00 1.43 0.00 0.00 31.44 31.30 2dno n GLU 69 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2dno s ASP 70 N 4.39 5.62 -0.14 -1.84 2.15 -1.26 -5.03 116.67 120.54 2dno s ASP 70 Ca 0.97 0.34 0.00 0.00 0.43 0.00 0.00 52.55 54.30 2dno s ASP 70 Cb -0.84 -1.43 -0.23 0.00 -0.30 0.00 0.00 42.92 40.12 2dno s ASP 70 CO 0.56 -0.92 0.26 0.54 -0.17 0.00 0.00 175.17 175.44 2dno n ARG 71 N -2.30 0.71 -1.49 4.34 1.74 -1.26 -4.91 116.66 113.49 2dno n ARG 71 Ca 0.04 0.22 -0.38 0.00 -0.77 0.00 0.00 57.85 56.96 2dno n ARG 71 Cb 0.58 -1.67 0.04 0.00 -1.02 0.00 0.00 32.46 30.39 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 -3.31 0.60 -4.38 5.56 4.81 -1.26 -4.09 118.16 116.09 2dno n LYS 72 Ca -0.33 0.23 -0.21 0.00 -0.87 0.00 0.00 58.31 57.14 2dno n LYS 72 Cb 1.04 -1.77 -0.16 0.00 0.02 0.00 0.00 35.03 34.17 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 0.37 1.70 -0.24 3.14 1.43 0.25 -2.78 118.68 122.55 2dno s LEU 73 Ca 0.69 -0.19 -0.20 0.00 -1.03 0.00 0.00 54.13 53.40 2dno s LEU 73 Cb -0.46 -0.56 -0.02 0.00 0.03 0.00 0.00 46.19 45.18 2dno s LEU 73 CO 0.54 0.04 0.62 0.12 0.23 0.00 0.00 176.35 177.90 2dno s PHE 74 N 0.36 3.31 -0.05 0.29 5.36 0.25 -1.08 117.98 126.42 2dno s PHE 74 Ca -0.06 0.83 0.01 0.00 -0.96 0.00 0.00 56.93 56.76 2dno s PHE 74 Cb -0.10 -2.82 -0.03 0.00 -0.34 0.00 0.00 43.02 39.73 2dno s PHE 74 CO 0.01 -0.28 -0.06 0.08 -1.46 0.00 0.00 175.22 173.51 2dno s VAL 75 N 2.31 3.75 0.03 3.12 1.01 -0.29 -0.86 120.40 129.47 2dno s VAL 75 Ca 0.26 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.70 2dno s VAL 75 Cb -0.16 -2.57 -0.00 0.00 0.00 0.00 0.00 36.38 33.65 2dno s VAL 75 CO 0.09 0.53 0.02 0.61 0.00 0.00 0.00 175.10 176.35 2dno n GLY 76 N 2.00 3.97 3.68 4.51 0.00 0.12 -1.90 105.19 117.58 2dno n GLY 76 Ca -0.17 -1.78 -0.28 0.00 0.00 0.00 0.00 46.02 43.79 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 -0.06 -4.67 -2.75 1.61 2.81 -1.21 -3.32 117.12 109.52 2dno n MET 77 Ca 0.00 0.58 -0.25 0.00 -1.81 0.00 0.00 57.70 56.22 2dno n MET 77 Cb 0.05 -5.41 0.02 0.00 -0.71 0.00 0.00 33.22 27.17 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 -6.99 3.52 0.31 4.03 1.43 -1.25 -4.74 118.68 114.99 2dno s LEU 78 Ca 0.56 0.54 0.10 0.00 -1.03 0.00 0.00 54.13 54.29 2dno s LEU 78 Cb -0.28 -3.41 -0.05 0.00 0.03 0.00 0.00 46.19 42.48 2dno s LEU 78 CO 0.69 -0.79 -0.03 -0.83 0.23 0.00 0.00 176.35 175.63 2dno s GLY 79 N -4.22 1.95 0.15 -3.19 0.00 -1.26 -4.74 107.32 96.01 2dno s GLY 79 Ca 0.50 -1.88 -0.14 0.00 0.00 0.00 0.00 44.72 43.19 2dno s GLY 79 CO 0.41 -1.88 1.68 0.50 0.00 0.00 0.00 173.10 173.82 2dno h LYS 80 N 1.90 0.74 -0.24 2.90 1.79 -1.92 -3.11 116.57 118.62 2dno h LYS 80 Ca -0.43 -0.15 0.06 0.00 -2.18 0.00 0.00 60.65 57.95 2dno h LYS 80 Cb 1.25 -0.11 -0.07 0.00 -1.58 0.00 0.00 32.23 31.72 2dno h LYS 80 CO 0.64 0.69 -0.31 1.96 -1.08 0.00 0.00 179.45 181.35 2dno h GLN 81 N 0.64 -0.32 -7.14 3.15 1.08 -1.96 -3.41 115.11 107.15 2dno h GLN 81 Ca 0.16 0.02 -0.54 0.00 -1.45 0.00 0.00 58.65 56.84 2dno h GLN 81 Cb 0.25 0.07 0.15 0.00 -0.05 0.00 0.00 27.48 27.90 2dno h GLN 81 CO -0.01 -0.21 0.45 -0.65 -0.95 0.00 0.00 178.83 177.47 2dno s GLN 82 N -6.01 2.45 0.26 1.46 -1.52 -1.18 -5.04 119.66 110.09 2dno s GLN 82 Ca -0.15 1.88 0.05 0.00 -1.95 0.00 0.00 55.36 55.19 2dno s GLN 82 Cb 0.12 -1.86 -0.02 0.00 -0.22 0.00 0.00 33.01 31.03 2dno s GLN 82 CO 0.67 -1.62 0.18 0.25 -0.25 0.00 0.00 175.29 174.51 2dno n THR 83 N -2.20 0.00 0.06 -0.19 -2.24 -1.26 -4.82 114.28 103.63 2dno n THR 83 Ca 0.14 -1.79 0.15 0.00 -2.27 0.00 0.00 64.05 60.29 2dno n THR 83 Cb 0.49 0.82 0.64 0.00 -2.10 0.00 0.00 70.33 70.17 2dno n THR 83 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 2dno h ASP 84 N 1.42 0.08 -0.33 3.42 3.04 -1.97 -1.49 116.42 120.58 2dno h ASP 84 Ca -0.19 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 53.55 2dno h ASP 84 Cb 0.89 -0.01 -0.01 0.00 -1.04 0.00 0.00 39.33 39.15 2dno h ASP 84 CO 0.29 0.05 0.03 -0.08 -2.04 0.00 0.00 179.24 177.49 2dno h GLU 85 N 0.08 0.57 0.00 4.15 4.81 -1.98 -2.16 114.58 120.06 2dno h GLU 85 Ca 0.18 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2dno h GLU 85 Cb 0.60 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.92 2dno h GLU 85 CO -0.02 0.67 0.00 -0.25 -0.73 0.00 0.00 179.01 178.69 2dno n ASP 86 N -4.56 0.00 -0.49 1.04 8.00 -0.59 -1.35 116.55 118.59 2dno n ASP 86 Ca -0.02 0.79 0.40 0.00 0.71 0.00 0.00 54.79 56.67 2dno n ASP 86 Cb 0.24 -0.34 0.69 0.00 -0.02 0.00 0.00 41.12 41.69 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 0.10 0.51 2.53 2.07 -1.62 0.71 116.25 120.56 2dno h VAL 87 Ca 0.00 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 2dno h VAL 87 Cb 0.00 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.82 2dno h VAL 87 CO 0.00 0.01 -0.24 -0.09 0.02 0.00 0.00 177.57 177.27 2dno h ARG 88 N 0.06 -0.66 0.00 1.57 2.43 -1.28 -0.08 114.38 116.42 2dno h ARG 88 Ca 0.84 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 60.05 2dno h ARG 88 Cb 2.83 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 32.53 2dno h ARG 88 CO -0.32 -0.44 0.00 0.87 -1.51 0.00 0.00 179.97 178.57 2dno h LYS 89 N -0.90 0.00 0.00 0.20 1.57 0.28 -0.07 116.57 117.65 2dno h LYS 89 Ca -0.07 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 2dno h LYS 89 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 2dno h LYS 89 CO 0.11 0.00 -0.83 1.98 -0.57 0.00 0.00 179.45 180.14 2dno h MET 90 N 0.00 0.00 0.00 3.15 4.05 0.43 -3.32 114.93 119.24 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 0.26 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.06 2dno h MET 90 CO 0.00 0.23 -1.50 1.19 0.23 0.00 0.00 176.91 177.06 2dno n PHE 91 N -2.96 0.01 -0.28 1.39 3.01 -0.05 -4.36 117.46 114.23 2dno n PHE 91 Ca -0.02 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.40 2dno n PHE 91 Cb 0.69 -0.27 0.06 0.00 -0.01 0.00 0.00 39.48 39.96 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 -1.15 -2.17 114.58 116.29 2dno h GLU 92 Ca 0.00 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2dno h GLU 92 Cb 0.76 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2dno h GLU 92 CO 0.00 0.70 0.45 -2.30 -1.00 0.00 0.00 179.01 176.86 2dno n PRO 93 N -4.52 0.07 -0.78 2.33 -0.02 -1.26 0.12 135.00 130.93 2dno n PRO 93 Ca 0.07 0.53 0.01 0.00 -2.02 0.00 0.00 63.50 62.10 2dno n PRO 93 Cb 0.04 -2.15 0.19 0.00 -0.02 0.00 0.00 33.50 31.55 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 -1.95 0.47 0.00 6.00 3.72 -0.82 -5.06 117.46 119.82 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 0.46 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 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 3.73 3.64 1.37 0.00 0.32 -4.31 105.19 108.86 2dno n GLY 95 Ca 0.24 -1.70 -0.43 0.00 0.00 0.00 0.00 46.02 44.13 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 -2.33 4.29 0.01 2.61 2.01 -1.26 -4.01 115.64 116.96 2dno s THR 96 Ca 0.00 1.50 -0.30 0.00 0.31 0.00 0.00 61.69 63.19 2dno s THR 96 Cb 0.00 -4.18 -0.05 0.00 0.01 0.00 0.00 72.50 68.28 2dno s THR 96 CO 0.00 -0.37 1.27 -0.63 -0.69 0.00 0.00 174.62 174.19 2dno s ILE 97 N 3.93 3.97 -0.10 1.82 1.01 -1.26 -0.02 121.20 130.55 2dno s ILE 97 Ca 0.53 1.36 0.16 0.00 0.00 0.00 0.00 60.65 62.70 2dno s ILE 97 Cb -0.17 -3.88 -0.17 0.00 0.01 0.00 0.00 42.46 38.26 2dno s ILE 97 CO 0.18 0.04 0.77 -0.67 0.00 0.00 0.00 174.94 175.26 2dno n ASP 98 N 4.77 0.86 -3.69 3.58 -0.08 -0.54 -4.85 116.55 116.60 2dno n ASP 98 Ca 0.11 0.39 -0.15 0.00 -1.51 0.00 0.00 54.79 53.63 2dno n ASP 98 Cb 0.45 0.10 -0.08 0.00 2.34 0.00 0.00 41.12 43.93 2dno n ASP 98 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2dno s GLU 99 N -2.82 0.79 -0.28 -0.67 2.12 -1.21 -5.02 118.70 111.59 2dno s GLU 99 Ca -0.03 -0.04 -0.09 0.00 0.36 0.00 0.00 54.97 55.17 2dno s GLU 99 Cb 0.08 0.36 0.13 0.00 0.26 0.00 0.00 34.13 34.96 2dno s GLU 99 CO 0.82 -0.23 0.61 0.00 -0.54 0.00 0.00 175.26 175.92 2dno s THR 101 N 2.85 -0.05 0.30 0.00 2.01 -0.90 -5.03 115.64 114.82 2dno s THR 101 Ca -0.03 0.19 -0.13 0.00 0.31 0.00 0.00 61.69 62.03 2dno s THR 101 Cb -0.12 -0.22 -0.08 0.00 0.01 0.00 0.00 72.50 72.09 2dno s THR 101 CO -0.18 0.08 0.68 -0.69 -0.69 0.00 0.00 174.62 173.81 2dno s VAL 102 N 1.17 4.78 -0.25 3.82 1.01 -1.26 -1.03 120.40 128.64 2dno s VAL 102 Ca -0.09 0.75 -0.10 0.00 0.00 0.00 0.00 61.98 62.54 2dno s VAL 102 Cb -0.12 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 2dno s VAL 102 CO -0.06 -0.18 0.15 -0.76 0.00 0.00 0.00 175.10 174.25 2dno s LEU 103 N -3.01 3.94 0.27 3.92 1.43 -0.67 -4.93 118.68 119.63 2dno s LEU 103 Ca 0.52 0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.65 2dno s LEU 103 Cb -0.10 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 43.99 2dno s LEU 103 CO 0.20 0.02 0.06 -0.13 0.23 0.00 0.00 176.35 176.73 2dno s ARG 104 N 1.32 1.46 0.00 1.70 0.52 -1.26 -2.94 118.95 119.75 2dno s ARG 104 Ca 0.07 -1.78 0.00 0.00 -0.52 0.00 0.00 55.73 53.49 2dno s ARG 104 Cb -0.15 -0.50 0.00 0.00 0.52 0.00 0.00 34.95 34.82 2dno s ARG 104 CO 0.06 -0.22 0.00 0.41 0.02 0.00 0.00 175.30 175.57 2dno n GLY 105 N -0.51 -1.55 0.20 -3.53 0.00 -1.11 -4.89 105.19 93.80 2dno n GLY 105 Ca -0.02 -1.52 0.09 0.00 0.00 0.00 0.00 46.02 44.58 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 0.00 0.08 1.61 0.13 -2.02 -3.31 132.00 128.49 2dno h PRO 106 Ca 0.00 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.79 2dno h PRO 106 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 2dno h PRO 106 CO 0.00 0.19 -1.91 -0.25 -0.23 0.00 0.00 178.00 175.80 2dno n ASP 107 N -3.19 2.05 0.00 1.44 8.00 -1.26 -5.01 116.55 118.58 2dno n ASP 107 Ca 0.02 0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.75 2dno n ASP 107 Cb 0.55 -0.84 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 2dno n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dno n GLY 108 N 1.87 0.88 3.64 0.44 0.00 -1.25 -5.11 105.19 105.67 2dno n GLY 108 Ca -0.34 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.20 2dno n GLY 108 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2dno n THR 109 N 0.00 0.52 -1.67 2.61 -1.04 -1.26 -4.59 114.28 108.85 2dno n THR 109 Ca 0.00 -0.17 -0.48 0.00 -2.04 0.00 0.00 64.05 61.36 2dno n THR 109 Cb 0.00 -1.98 -0.05 0.00 -1.82 0.00 0.00 70.33 66.48 2dno n THR 109 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2dno n SER 110 N 7.79 3.20 0.09 8.00 2.88 -1.26 -2.75 113.62 131.57 2dno n SER 110 Ca 0.26 1.02 -0.05 0.00 -1.33 0.00 0.00 58.87 58.77 2dno n SER 110 Cb 0.32 -1.38 0.12 0.00 -0.75 0.00 0.00 64.21 62.52 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 7.69 0.20 0.00 -1.46 1.79 -1.86 -3.48 116.57 119.46 2dno h LYS 111 Ca -0.47 -0.14 0.00 0.00 -2.18 0.00 0.00 60.65 57.86 2dno h LYS 111 Cb 1.27 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.94 2dno h LYS 111 CO 0.92 0.76 0.00 0.41 -1.08 0.00 0.00 179.45 180.46 2dno n GLY 112 N 0.29 0.97 3.55 3.86 0.00 -1.26 -5.01 105.19 107.58 2dno n GLY 112 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.24 -1.25 -0.33 0.00 0.00 -0.80 -1.66 121.76 115.48 2dno s ALA 114 Ca 0.03 0.53 -0.09 0.00 0.00 0.00 0.00 51.96 52.42 2dno s ALA 114 Cb -0.01 0.37 0.01 0.00 0.00 0.00 0.00 23.12 23.49 2dno s ALA 114 CO -0.04 -0.49 0.16 -0.06 0.00 0.00 0.00 175.76 175.32 2dno s PHE 115 N -2.44 3.20 -0.20 0.00 0.08 -0.20 -1.14 117.98 117.28 2dno s PHE 115 Ca -0.05 -0.84 -0.06 0.00 0.12 0.00 0.00 56.93 56.09 2dno s PHE 115 Cb -0.01 -2.36 -0.03 0.00 -0.57 0.00 0.00 43.02 40.05 2dno s PHE 115 CO -0.02 -0.56 0.03 0.08 -0.10 0.00 0.00 175.22 174.65 2dno s VAL 116 N 1.56 4.29 -0.10 -0.44 1.01 -0.24 -2.11 120.40 124.36 2dno s VAL 116 Ca 0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.79 2dno s VAL 116 Cb -0.18 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.22 2dno s VAL 116 CO 0.05 0.42 -0.02 -0.75 0.00 0.00 0.00 175.10 174.81 2dno s LYS 117 N 0.89 3.15 0.26 2.72 2.20 0.86 0.87 119.74 130.68 2dno s LYS 117 Ca 0.02 -0.45 0.07 0.00 -0.36 0.00 0.00 55.97 55.25 2dno s LYS 117 Cb -0.14 -2.80 -0.04 0.00 -1.51 0.00 0.00 37.83 33.34 2dno s LYS 117 CO 0.02 0.57 0.17 -0.06 -0.36 0.00 0.00 175.35 175.70 2dno s PHE 118 N -0.53 3.04 0.50 4.03 0.40 -1.26 -1.46 117.98 122.70 2dno s PHE 118 Ca 0.09 -0.14 0.19 0.00 -0.60 0.00 0.00 56.93 56.47 2dno s PHE 118 Cb -0.12 -1.39 1.29 0.00 0.51 0.00 0.00 43.02 43.31 2dno s PHE 118 CO 0.02 0.52 2.11 0.37 0.70 0.00 0.00 175.22 178.93 2dno h GLN 119 N 1.54 0.00 -3.78 0.44 4.15 -0.77 -3.40 115.11 113.27 2dno h GLN 119 Ca -0.48 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 58.85 2dno h GLN 119 Cb 1.24 0.00 -0.10 0.00 0.21 0.00 0.00 27.48 28.84 2dno h GLN 119 CO 0.61 0.07 -0.17 0.95 -1.93 0.00 0.00 178.83 178.36 2dno s THR 120 N -4.77 0.00 -0.01 2.39 -4.23 -1.26 -5.03 115.64 102.73 2dno s THR 120 Ca -0.04 -1.48 -0.17 0.00 -1.18 0.00 0.00 61.69 58.82 2dno s THR 120 Cb 0.16 -2.28 -0.09 0.00 1.34 0.00 0.00 72.50 71.62 2dno s THR 120 CO 0.65 0.00 0.82 -0.74 -0.54 0.00 0.00 174.62 174.81 2dno h HIS 121 N 2.28 -0.55 -0.86 3.99 -0.00 -1.91 -2.35 115.15 115.75 2dno h HIS 121 Ca -0.27 -0.01 0.23 0.00 -0.00 0.00 0.00 60.37 60.32 2dno h HIS 121 Cb 1.25 0.18 -0.16 0.00 -0.00 0.00 0.00 27.41 28.68 2dno h HIS 121 CO 0.49 -0.34 0.01 0.00 -0.00 0.00 0.00 177.93 178.09 2dno n ALA 122 N -2.55 0.43 0.01 5.26 0.00 -1.26 0.66 120.51 123.06 2dno n ALA 122 Ca -0.07 0.92 -0.13 0.00 0.00 0.00 0.00 53.44 54.16 2dno n ALA 122 Cb 0.24 -0.67 -0.09 0.00 0.00 0.00 0.00 19.45 18.93 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 -0.01 -0.62 0.00 4.39 -1.82 -1.22 114.58 115.30 2dno h GLU 123 Ca 0.52 0.00 0.10 0.00 0.34 0.00 0.00 59.36 60.31 2dno h GLU 123 Cb 1.05 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.63 2dno h GLU 123 CO -0.81 0.26 0.24 0.00 -1.16 0.00 0.00 179.01 177.53 2dno h ALA 124 N 0.72 0.81 -0.61 3.43 0.00 0.80 -1.55 119.26 122.86 2dno h ALA 124 Ca -0.00 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2dno h ALA 124 Cb 0.27 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2dno h ALA 124 CO 0.00 -0.18 0.06 0.37 0.00 0.00 0.00 179.25 179.50 2dno h GLN 125 N 0.42 1.04 -0.57 0.00 -0.00 -0.77 -3.08 115.11 112.16 2dno h GLN 125 Ca 0.32 -0.30 0.11 0.00 -0.00 0.00 0.00 58.65 58.78 2dno h GLN 125 Cb 0.39 -0.11 -0.11 0.00 0.00 0.00 0.00 27.48 27.66 2dno h GLN 125 CO -0.31 0.99 -0.15 0.00 0.00 0.00 0.00 178.83 179.36 2dno h ALA 126 N 1.01 0.35 0.07 3.38 0.00 -0.18 -1.69 119.26 122.19 2dno h ALA 126 Ca 0.18 0.22 0.03 0.00 0.00 0.00 0.00 54.91 55.33 2dno h ALA 126 Cb 0.48 0.45 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2dno h ALA 126 CO 0.02 -0.45 -0.32 0.00 0.00 0.00 0.00 179.25 178.50 2dno h ALA 127 N 1.53 -0.51 -0.30 0.00 0.00 -1.40 -2.88 119.26 115.70 2dno h ALA 127 Ca 0.27 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.19 2dno h ALA 127 Cb 0.43 0.55 -0.08 0.00 0.00 0.00 0.00 17.79 18.69 2dno h ALA 127 CO -0.59 -0.85 -0.50 0.82 0.00 0.00 0.00 179.25 178.12 2dno h ILE 128 N -0.51 0.05 -0.77 0.00 2.04 -1.34 1.90 117.51 118.87 2dno h ILE 128 Ca 0.04 0.00 0.32 0.00 1.00 0.00 0.00 64.86 66.23 2dno h ILE 128 Cb 0.57 0.05 -0.14 0.00 -0.74 0.00 0.00 36.82 36.55 2dno h ILE 128 CO -0.22 0.00 0.41 0.59 0.00 0.00 0.00 178.15 178.93 2dno n ASN 129 N -5.41 0.27 0.00 1.72 4.13 -0.78 -0.37 115.26 114.81 2dno n ASN 129 Ca -0.04 1.28 0.00 0.00 1.68 0.00 0.00 54.58 57.51 2dno n ASN 129 Cb 0.36 -0.62 0.00 0.00 -1.54 0.00 0.00 39.78 37.98 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 -4.75 0.00 -0.26 3.41 -1.04 0.07 -4.67 114.28 107.04 2dno n THR 130 Ca 0.29 0.32 0.09 0.00 -2.04 0.00 0.00 64.05 62.71 2dno n THR 130 Cb 0.99 -1.30 0.18 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 -2.36 -0.15 -4.66 -4.42 4.77 0.63 -3.81 117.00 107.00 2dno n LEU 131 Ca 0.00 1.26 -0.55 0.00 -0.03 0.00 0.00 56.01 56.69 2dno n LEU 131 Cb 0.00 -0.43 -0.07 0.00 -2.33 0.00 0.00 43.42 40.59 2dno n LEU 131 CO 0.00 -1.25 1.45 1.57 -1.33 0.00 0.00 177.39 177.82 2dno n HIS 132 N -5.09 2.02 -3.89 -1.77 -0.00 0.50 -0.77 115.22 106.22 2dno n HIS 132 Ca 0.15 0.40 -0.26 0.00 0.46 0.00 0.00 57.72 58.47 2dno n HIS 132 Cb 0.50 -2.51 0.00 0.00 -0.12 0.00 0.00 29.99 27.86 2dno n HIS 132 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2dno n SER 133 N 6.39 -1.69 0.00 0.26 2.88 0.92 -4.93 113.62 117.45 2dno n SER 133 Ca 0.29 -0.91 0.00 0.00 -1.33 0.00 0.00 58.87 56.92 2dno n SER 133 Cb 0.17 -3.49 0.00 0.00 -0.75 0.00 0.00 64.21 60.14 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 -2.95 0.00 -5.02 -3.46 2.88 0.05 -4.87 113.62 100.25 2dno n SER 134 Ca -0.20 0.02 -0.19 0.00 -1.33 0.00 0.00 58.87 57.17 2dno n SER 134 Cb 0.63 -0.25 0.05 0.00 -0.75 0.00 0.00 64.21 63.89 2dno n SER 134 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dno s ARG 135 N -0.50 2.45 -0.49 -1.46 1.70 -1.26 -4.88 118.95 114.51 2dno s ARG 135 Ca 0.00 -1.51 0.04 0.00 -0.47 0.00 0.00 55.73 53.79 2dno s ARG 135 Cb 0.00 -2.67 0.16 0.00 -0.57 0.00 0.00 34.95 31.87 2dno s ARG 135 CO 0.00 -0.70 0.36 0.99 -1.08 0.00 0.00 175.30 174.87 2dno s THR 136 N -2.59 1.14 0.28 4.99 2.01 -1.26 -0.52 115.64 119.69 2dno s THR 136 Ca 0.60 -3.02 -0.26 0.00 0.31 0.00 0.00 61.69 59.32 2dno s THR 136 Cb -0.07 -1.78 -0.16 0.00 0.01 0.00 0.00 72.50 70.50 2dno s THR 136 CO 0.37 -1.12 0.43 0.18 -0.69 0.00 0.00 174.62 173.80 2dno n LEU 137 N 2.76 -1.42 -4.71 4.42 4.77 -1.26 -4.69 117.00 116.86 2dno n LEU 137 Ca 0.24 1.03 -0.58 0.00 -0.03 0.00 0.00 56.01 56.67 2dno n LEU 137 Cb 0.42 -0.96 -0.07 0.00 -2.33 0.00 0.00 43.42 40.48 2dno n LEU 137 CO 0.15 -3.21 1.32 -2.65 -1.33 0.00 0.00 177.39 171.67 2dno n PRO 138 N 1.05 1.12 -2.24 3.23 -0.02 -1.26 -2.11 135.00 134.77 2dno n PRO 138 Ca 0.15 0.41 -0.02 0.00 -2.02 0.00 0.00 63.50 62.02 2dno n PRO 138 Cb 0.30 -2.09 0.01 0.00 -0.02 0.00 0.00 33.50 31.71 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 4.17 0.40 2.71 -1.23 0.00 -1.26 -4.83 105.19 105.15 2dno n GLY 139 Ca 0.27 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.04 1.05 0.00 4.61 0.00 -0.90 -4.89 121.76 118.59 2dno s ALA 140 Ca 0.01 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.04 2dno s ALA 140 Cb -0.00 -1.29 0.00 0.00 0.00 0.00 0.00 23.12 21.83 2dno s ALA 140 CO 0.09 -1.33 0.43 0.45 0.00 0.00 0.00 175.76 175.40 2dno n SER 141 N 5.04 0.00 -3.48 0.00 2.88 -1.26 -4.59 113.62 112.22 2dno n SER 141 Ca -0.07 0.43 -0.10 0.00 -1.33 0.00 0.00 58.87 57.79 2dno n SER 141 Cb 0.46 -0.14 0.04 0.00 -0.75 0.00 0.00 64.21 63.81 2dno n SER 141 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dno n SER 142 N -1.70 1.02 -4.53 -3.46 7.64 -1.26 -5.11 113.62 106.22 2dno n SER 142 Ca 0.00 -1.76 -0.29 0.00 1.01 0.00 0.00 58.87 57.83 2dno n SER 142 Cb 0.00 -0.24 0.16 0.00 -1.01 0.00 0.00 64.21 63.12 2dno n SER 142 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dno s SER 143 N -2.89 3.01 -0.20 6.43 0.01 -1.26 -4.79 113.70 114.02 2dno s SER 143 Ca 0.32 0.81 -0.32 0.00 1.31 0.00 0.00 55.95 58.06 2dno s SER 143 Cb -0.02 -1.26 -0.09 0.00 0.21 0.00 0.00 66.02 64.86 2dno s SER 143 CO 0.20 -2.85 2.08 -0.11 0.41 0.00 0.00 173.24 172.98 2dno n LEU 144 N -3.94 3.06 -4.49 2.44 7.94 0.32 -4.72 117.00 117.62 2dno n LEU 144 Ca 0.09 0.58 -0.43 0.00 -1.11 0.00 0.00 56.01 55.14 2dno n LEU 144 Cb 0.59 -1.40 -0.04 0.00 0.53 0.00 0.00 43.42 43.10 2dno n LEU 144 CO 0.54 -0.42 0.77 -0.69 -1.11 0.00 0.00 177.39 176.47 2dno s VAL 145 N 6.31 4.33 -0.22 1.96 1.01 -1.21 -0.06 120.40 132.52 2dno s VAL 145 Ca 1.00 -0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.91 2dno s VAL 145 Cb -0.62 -4.63 0.02 0.00 0.00 0.00 0.00 36.38 31.15 2dno s VAL 145 CO 0.46 -1.33 -0.10 -0.69 0.00 0.00 0.00 175.10 173.44 2dno s VAL 146 N 4.08 2.75 -0.18 2.92 1.01 -1.26 0.14 120.40 129.87 2dno s VAL 146 Ca 0.26 -0.89 -0.15 0.00 0.00 0.00 0.00 61.98 61.19 2dno s VAL 146 Cb -0.15 -2.31 0.05 0.00 0.00 0.00 0.00 36.38 33.97 2dno s VAL 146 CO 0.14 0.34 0.46 -1.59 0.00 0.00 0.00 175.10 174.45 2dno s LYS 147 N 1.35 0.53 0.55 2.72 -2.85 -0.04 -4.61 119.74 117.39 2dno s LYS 147 Ca 0.02 0.67 -0.15 0.00 -1.00 0.00 0.00 55.97 55.51 2dno s LYS 147 Cb -0.15 0.23 -0.13 0.00 -2.06 0.00 0.00 37.83 35.72 2dno s LYS 147 CO -0.06 -0.08 -0.26 1.19 0.10 0.00 0.00 175.35 176.24 2dno n PHE 148 N 2.99 -3.05 -3.33 1.78 3.01 -1.26 0.86 117.46 118.45 2dno n PHE 148 Ca -0.14 0.28 -0.19 0.00 1.01 0.00 0.00 57.45 58.41 2dno n PHE 148 Cb 0.57 -1.40 0.00 0.00 -0.01 0.00 0.00 39.48 38.63 2dno n PHE 148 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2dno s ALA 149 N -1.73 4.26 -0.30 4.37 0.00 -1.12 -3.92 121.76 123.32 2dno s ALA 149 Ca 0.45 -1.47 -0.08 0.00 0.00 0.00 0.00 51.96 50.86 2dno s ALA 149 Cb -0.36 -1.71 0.16 0.00 0.00 0.00 0.00 23.12 21.22 2dno s ALA 149 CO 0.61 -0.12 0.72 0.34 0.00 0.00 0.00 175.76 177.31 2dno s ASP 150 N -4.22 -1.09 0.01 0.00 -1.08 -1.26 -4.90 116.67 104.14 2dno s ASP 150 Ca 0.47 1.12 0.05 0.00 -0.52 0.00 0.00 52.55 53.67 2dno s ASP 150 Cb -0.10 2.09 -0.02 0.00 -1.46 0.00 0.00 42.92 43.43 2dno s ASP 150 CO 0.32 -0.21 -0.17 -0.89 0.52 0.00 0.00 175.17 174.75 2dno s THR 151 N 2.82 1.31 -0.25 1.71 2.01 -1.26 -5.13 115.64 116.86 2dno s THR 151 Ca 0.04 -0.82 -0.01 0.00 0.31 0.00 0.00 61.69 61.21 2dno s THR 151 Cb -0.12 -1.11 0.04 0.00 0.01 0.00 0.00 72.50 71.31 2dno s THR 151 CO -0.19 0.28 -0.07 -1.61 -0.69 0.00 0.00 174.62 172.34 2dno s GLU 152 N -0.63 2.67 -0.09 4.92 2.02 -1.26 -5.10 118.70 121.23 2dno s GLU 152 Ca 0.06 -1.08 -0.00 0.00 0.02 0.00 0.00 54.97 53.97 2dno s GLU 152 Cb -0.07 -2.96 -0.03 0.00 0.10 0.00 0.00 34.13 31.17 2dno s GLU 152 CO 0.00 -0.45 -0.07 0.21 0.02 0.00 0.00 175.26 174.97 2dno s LYS 153 N 1.27 2.95 0.01 1.61 2.36 -1.26 -5.12 119.74 121.56 2dno s LYS 153 Ca -0.02 -0.55 -0.02 0.00 -2.55 0.00 0.00 55.97 52.83 2dno s LYS 153 Cb -0.17 -2.65 -0.01 0.00 -1.05 0.00 0.00 37.83 33.94 2dno s LYS 153 CO -0.05 0.56 0.02 -1.83 1.55 0.00 0.00 175.35 175.60 2dno s GLU 154 N -0.53 0.32 0.33 4.03 1.03 -1.26 -5.17 118.70 117.45 2dno s GLU 154 Ca 0.08 -0.49 0.09 0.00 0.03 0.00 0.00 54.97 54.68 2dno s GLU 154 Cb -0.12 0.12 -0.05 0.00 -0.80 0.00 0.00 34.13 33.28 2dno s GLU 154 CO 0.02 -0.06 -0.00 0.45 -1.33 0.00 0.00 175.26 174.33 2dno s SER 155 N -1.28 4.17 -0.40 0.83 0.15 -1.26 -5.11 113.70 110.80 2dno s SER 155 Ca -0.14 -0.96 0.04 0.00 0.70 0.00 0.00 55.95 55.59 2dno s SER 155 Cb -0.08 -0.54 0.11 0.00 -1.71 0.00 0.00 66.02 63.79 2dno s SER 155 CO -0.00 -0.20 0.12 -0.83 1.20 0.00 0.00 173.24 173.53 2dno s GLY 156 N -3.70 2.05 0.16 9.45 0.00 -1.26 -5.10 107.32 108.93 2dno s GLY 156 Ca 0.34 -2.73 -0.30 0.00 0.00 0.00 0.00 44.72 42.03 2dno s GLY 156 CO 0.19 1.00 1.15 2.56 0.00 0.00 0.00 173.10 178.00 2dno s PRO 157 N 0.55 4.53 0.00 2.90 0.04 -1.26 -5.04 135.00 136.73 2dno s PRO 157 Ca 0.13 1.77 -0.21 0.00 0.04 0.00 0.00 61.00 62.73 2dno s PRO 157 Cb -0.21 -3.28 0.04 0.00 0.04 0.00 0.00 34.50 31.09 2dno s PRO 157 CO -0.06 -0.04 0.46 -1.12 0.04 0.00 0.00 177.00 176.28 2dno s SER 158 N 0.20 -0.37 0.29 6.66 0.01 -1.26 -5.18 113.70 114.04 2dno s SER 158 Ca 0.52 0.24 -0.20 0.00 1.31 0.00 0.00 55.95 57.82 2dno s SER 158 Cb -0.30 0.43 0.04 0.00 0.21 0.00 0.00 66.02 66.40 2dno s SER 158 CO 0.34 -0.59 0.81 -0.44 0.41 0.00 0.00 173.24 173.77 2dno s SER 159 N -1.56 -0.14 0.00 2.44 0.01 -1.26 -5.35 113.70 107.83 2dno s SER 159 Ca -0.10 -0.75 0.05 0.00 1.31 0.00 0.00 55.95 56.46 2dno s SER 159 Cb -0.02 0.71 0.04 0.00 0.21 0.00 0.00 66.02 66.96 2dno s SER 159 CO 0.03 -1.36 0.65 0.61 0.41 0.00 0.00 173.24 173.59